============================================================================= Cases of Pseudo Symmetry or real missed Symmetry in the CSD (apr 1999) for Cc ============================================================================= Missed symmetry is an important issue, illustrated with many examples by Dick Marsh and others in the literature. It has been estimated that in the order of 10% of the structures published in space group Cc are better described in a higher symmetry space group. Software is now available to warn for suspected cases of structure refinement in space groups with too low symmetry. Following is the result of an (automatic) investigation using PLATON/ADDSYM on the data available for structures in the CSD with space group #9 (=Cc). In total 1970 entries were examined of which 293 were shown in need for more detailed inspection. About 120 cases (out of the 293 referred to above) have now been corrected for in the literature. 173 entries were found to pass the criteria for higher symmetry for all atoms (i.e. 100%). A large number of those cases have been corrected in the literature by Dick Marsh and others. Other cases are very close to higher symmetry, but deviate from that for a variety of reasons such as packing. The remaining cases (120) may be either overrefined (poor geometry), wrong atom assignments, incomplete data or cases of pseudo-symmetry. (less than 100% fits). Dick Marsh and others also reported on cases of missed symmetry falling in this class. Probably well over 50 % of the 'alerted' cases are real hits. (Several additional cases were assured by Dick Marsh from this list but not yet published). Final analysis will often require a detailed study of the structure and access to the reflection data. The main message of the listing presented below is that cases of close to higher symmetry should be investigated well and discussed in some detail in the associated publication (what may have been the case in several entries listed below). Running routinely programs like NRCVAX/MISSYM (C) (Y.Lepage) or its extended version PLATON/ADDSYM should avoid 'being Marshed' after publication. Warning: (Substitutional) Disorder, either present explicitly in the published model or implicitly (i.e. not in the model) may go unnoticed ! For more details see 'http://www.cryst.chem.uu.nl/platon/pl000401.html' =========================================================================== ======================================================================== *** NOTE: THE LISTING BELOW CONTAINS A.L.E.R.T.S THAT MAY BE FALSE !! ** ======================================================================== AACRUB Cc R=0.0380 mC => mC 0.000 0.00 0.000 100% C2/c tetrakis(mu!2$-Acetato-O,O')-bis(aqua-ruthenium) tetrafluoroborate for re-refinement see Marsh and Schomaker,Inorg. Chem.,20,299,1981 C8 H16 O10 Ru2 1+,B1 F4 1- A.Bino,F.A.Cotton,T.R.Felthouse Inorg.Chem., 18, 2599,1979 AETXCO Cc R=0.0740 mC => oA 0.000 0.00 0.203 95% Ama2 Ammine-(diethylenetriamine-N,N',N'')-(oxalato-O,O')-cobalt(iii) nitrate C6 H16 Co1 N4 O4 1+,N1 O3 1- M.C.Couldwell,D.A.House,B.R.Penfold Inorg.Chim.Acta, 13, 61,1975 AMESNC Cc R=0.0268 mC => mC 0.000 0.00 0.000 100% C2/c bis(beta-Amidoethyl)-dichloro-tin(iv) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (AMESNC01) C6 H12 Cl2 N2 O2 Sn1 P.G.Harrison,T.J.King,M.A.Healy J.Organomet.Chem., 182, 17,1979 AMHCLA01 Cc R=0.1060 mC => mC 0.000 0.00 0.000 100% C2/c Ammonium hydrogen bis(chloroacetate) ferroelectric form, at 80 deg.K C2 H2 Cl1 O2 1-,C2 H3 Cl1 O2,H4 N1 1+ M.Ichikawa Acta Crystallogr.,Sect.B, 30, 651,1974 ANLINC Cc R=0.1000 mC => mC 0.000 0.00 0.000 87% C2/c Aniline hydrochloride C6 H8 N1 1+,Cl1 1- C.J.Brown Acta Crystallogr., 2, 228,1949 APENCU01 Cc R=0.0424 mC => mC 0.000 0.00 0.000 100% C2/c Aqua-bis(1,10-phenanthroline)-copper(ii) dinitrate C24 H18 Cu1 N4 O1 2+,2(N1 O3 1-) K.J.Catalan,S.Jackson,J.D.Zubkowski,D.L.Perry,E.J.Valente,L.A.Feliu,A.Polanco Polyhedron, 14, 2165,1995 BEFGOI Cc R=0.0630 mC => mC 0.000 0.00 0.000 100% C2/c 2-Piperidino-tricyclo(5.2.2.0$2,6!)undecan-9-one for reinterpretation and re-refinement see Marsh and Herbstein, Acta Cryst.,B44, 77,1988 C16 H25 N1 O1 K.A.Nirmala,D.S.S.Gowda Acta Crystallogr.,Sect.B, 38, 839,1982 BENGUW Cc R=0.0430 mC => mC 0.000 0.00 0.000 81% C2/c bis((p-Methoxyphenyl)-diazenido)-(N,N'-dimethyl-N,N'-bis(mercaptoethyl)-ethylene diamine)-molybdenum(vi) for re-refinement see Marsh and Toy, Inorg.Chem.,22,1691,1983 C22 H32 Mo1 N6 O2 S2 P.L.Dahlstrom,J.R.Dilworth,P.Shulman,J.Zubieta Inorg.Chem., 21, 933,1982 BENZSS05 Cc R=0.0450 mC => mC 0.000 0.00 0.000 100% C2/c Dibenzyl disulfide C14 H14 S2 Zhang Zhigui,Wang Fengshan Hua Hsueh Tung Pao(Chemical Bulletin), , 18-5,1984 BENZSS10 Cc R=0.0790 mC => mC 0.000 0.00 0.000 100% C2/c Dibenzyl disulfide space group no.9 C14 H14 S2 J.D.Lee,M.W.R.Bryant Acta Crystallogr.,Sect.B, 25, 2497,1969 BEYKIZ Cc R=0.0575 mC => mC 0.000 0.00 0.000 100% C2/c rac-Ethylene-dichloro-bis(4,5,6,7-tetrahydro-1-indenyl)-titanium at 228 deg.K, for stereoisomer (meso) see BEYKOF C20 H24 Cl2 Ti1 F.R.W.P.Wild,L.Zsolnai,G.Huttner,H.H.Brintzinger J.Organomet.Chem., 232, 233,1982 BIHHEF Cc R=0.1160 mC => mC 0.000 0.00 0.000 100% C2/c Potassium fluoride malonic acid for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (BIHHEF01). C3 H4 O4,K1 1+,F1 1- J.Emsley,D.J.Jones,R.Kuroda J.Chem.Soc.,Dalton Trans., , 1179,1982 BONVAB10 Cc R=0.0570 mC => oF 0.000 0.02 0.026 100% Fdd2 Dithia(3.3.1)propellane for reinterpretation and re-refinement see Marsh et al,Acta Cryst., B44,77,1988 C7 H10 S2 F.H.Herbstein,P.Ashkenazi,M.Kaftory,M.Kapon,G.M.Reisner,D.Ginsburg Acta Crystallogr.,Sect.B (Str.Sci.), 42, 575,1986 BORGUK Cc R=0.0780 mC => mC 0.000 0.00 0.000 97% C2/c bcfih,edgjk-bis(mu!2$-(8-(sigma-Methylene)-2,3,13,14-pentadecanetetraone-tetraox imato))-al-dipyridine-di-cobalt dihydrate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (BORGUK01). C42 H64 Co2 N10 O8,2(H2 O1) J.A.Robinson,H.Flohr,U.M.Kempe,W.Pannhorst,J.Retey Liebigs Ann.Chem., , 181,1983 BPBRNI Cc R=0.0880 mC => hR 0.000 0.00 0.113 100% R3c Tri-t-butylphosphonium tribromo-(tri-t-butylphosphine)-nickel(ii) C12 H27 Br3 Ni1 P1 1-,C12 H28 P1 1+ E.C.Alyea,A.Costin,G.Ferguson,G.T.Fey,R.G.Goel,R.J.Restivo J.Chem.Soc.,Dalton Trans., , 1294,1975 BRMENP Cc R=0.0799 mC => mC 0.000 0.00 0.000 100% C2/c 1,2:3,4-bis(Dibromomethano)-1,2,3,4-tetrahydro-octamethylnaphthalene C20 H24 Br4 A.Oku,H.Tsuji,M.Yoshida,N.Yoshiura J.Am.Chem.Soc., 103, 1244,1981 BRMENP10 Cc R=0.0800 mC => mC 0.000 0.00 0.000 100% C2/c 1,2:3,4-bis(Dibromomethano)-1,2,3,4-tetrahydro-octamethylnaphthalene for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (BRMENP01) C20 H24 Br4 A.Oku,K.Harada,T.Yagi,Y.Shirahase J.Am.Chem.Soc., 105, 4400,1983 BUHBUB Cc R=0.0800 mC => mC 0.000 0.00 0.000 100% C2/c Spiro(isoindoline-4-(3,4,5,6-tetrahydro-2,2,7,7-tetramethyl-3-carbomethoxy)-3'-( 2',2',5',5'-tetramethyl-4'-methylenecarbomethoxy)-pyrrole) monohydrate for reinterpretation see Marsh and Herbstein, Acta Cryst.,B44,77,1988 C24 H38 N2 O4,H2 O1 G.Bocelli Cryst.Struct.Commun., 11, 2035,1982 BUVYIA Cc R=0.0532 mC => oF 0.000 0.00 0.038 100% Fdd2 2-(Benzylcarbonyl-carbamoyl)-4-(2,2,2-trichloro-ethoxycarbonyl)-5-methyl-1,3-thi azole monohydrate for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (BUVYIA01). C16 H13 Cl3 N2 O4 S1,H2 O1 R.A.Fletton,D.C.Humber,S.M.Roberts,P.G.Owston,K.Henrick J.Chem.Soc.,Chem.Comm., , 968,1983 BUWCAX B11b R=0.0880 mB => oF 0.000 0.13 0.038 100% Fdd2 2,2',4,4'-Tetra-aminodiphenyl at -120 deg.C, for reinterpretation see Marsh and Herbstein, Acta Cryst.,B44,77, 1988. C12 H14 N4 G.V.Gridunova,V.E.Shklover,Yu.T.Struchkov,B.A.Chayanov Kristallografiya, 28, 286,1983 BUXFEF Cc R=0.0285 mC => mC 0.000 0.00 0.000 100% C2/c Dichloro-dihydro-tetrakis(trimethylphosphine)-tantalum at -160 deg.C C12 H38 Cl2 P4 Ta1 M.L.Luetkens Junior,J.C.Huffman,A.P.Sattelberger J.Am.Chem.Soc., 105, 4474,1983 BUXFEF10 Cc R=0.0285 mC => mC 0.000 0.00 0.000 100% C2/c Dichloro-dihydro-tetrakis(trimethylphosphine)-tantalum at -160 deg.C C12 H38 Cl2 P4 Ta1 M.L.Luetkens Junior,W.L.Elcesser,J.C.Huffman,A.P.Sattelberger Inorg.Chem., 23, 1718,1984 BZCPRU Cc R=0.0600 mC => mC 0.000 0.00 0.000 94% C2/c (Benzoato-O,O')-chloro-carbonyl-bis(triphenylphosphine)-ruthenium(ii) C44 H35 Cl1 O3 P2 Ru1 M.F.McGuiggan,L.H.Pignolet Cryst.Struct.Commun., 7, 583,1978 BZDIOX01 Cc R=0.0510 mC => mC 0.000 0.00 0.000 100% C2/c Dibenzo-p-dioxin for re-refinement see BZDIOX02 C12 H8 O2 A.W.Cordes,C.K.Fair Acta Crystallogr.,Sect.B, 30, 1621,1974 CAGROR Cc R=0.0480 mC => oF 0.000 0.02 0.019 100% Fdd2 Diaqua-tetrakis(3-methylpyridine)-nickel(ii) bis(hexafluorophosphate) 3-methylpy ridine solvate for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CAGROR01) C24 H32 N4 Ni1 O2 2+,2(F6 P1 1-),2(C6 H7 N1) R.M.Morrison,R.C.Thompson,J.Trotter Can.J.Chem., 61, 1651,1983 CASWOI10 Cc R=0.0600 mC => mC 0.000 0.00 0.000 98% C2/c Nitrosyl-bis(trifluoroacetato-O)-bis(triphenylphosphine)-rhodium for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CASWOI01). C40 H30 F6 N1 O5 P2 Rh1 A.Dobson,D.S.Moore,S.D.Robinson,A.M.R.Galas,M.B.Hursthouse J.Chem.Soc.,Dalton Trans., , 611,1985 CBUDCX Cc R=0.0411 mC => mC 0.000 0.00 0.000 90% C2/c Cyclobut-1-ene-1,2-dicarboxylic acid C6 H6 O4 D.Bellus,H.-C.Mez,G.Rihs J.Chem.Soc.,Perkin Trans.2, , 884,1974 CDAPSC10 Ia R=0.0390 mI => mC 0.000 0.00 0.000 85% C2/c Aqua-chloro-(2,6-diacetylpyridine-bis(semicarbazone)) cobalt(ii) chloride monohy drate C11 H17 Cl1 Co1 N7 O3 1+,Cl1 1-,H2 O1 G.J.Palenik,D.W.Wester Inorg.Chem., 17, 864,1978 CEDHEY Cc R=0.0350 mC => oF 0.000 0.60 0.173 100% Fdd2 bis(eta$5!-Cyclopentadienyl)-1,2-dimethoxyethane-ytterbium(ii) redetermination in CEDHEY01 C14 H20 O2 Yb1 G.B.Deacon,P.I.Mackinnon,T.W.Hambley,J.C.Taylor J.Organomet.Chem., 259, 91,1983 CEMXOH01 Cc R=0.0500 mC => mC 0.000 0.00 0.000 100% C2/c bis(Nitrato-O,O')-bis(mu!2$-bis(diphenylphosphino)methane-P,P')-di-silver C50 H44 Ag2 N2 O6 P4 Peng Zhang,Ming-Sheng Huang,Ying Zhang,Lan-Sun Zheng,Hua-Hui Yang Huaxue Xuebao(Acta Chim.Sinica)(Chin.), 49, 1120,1991 CERTUO Cc R=0.0415 mC => mC 0.000 0.00 0.000 100% C2/c tris((1,2-Dimethoxyethane)-lithium)-hexamethyl-lutetium at -100 deg.C C18 H48 Li3 Lu1 O6 H.Schumann,H.Lauke,E.Hahn,J.Pickardt J.Organomet.Chem., 263, 29,1984 CHXARH B11b R=0.0460 mB => mC 0.000 0.00 0.000 100% C2/c Dichloro-(cyclohexane-1,2-diamine-tetra-acetato-N,N',O,O')-rhodium(iii) oxonium monohydrate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CHXARH01). C14 H20 Cl2 N2 O8 Rh1 1-,H3 O1 1+,H2 O1 T.V.Filippova,T.N.Polynova,A.L.Il'inskii,M.A.Porai-Koshits,N.A.Ezerskaya Zh.Neorg.Khim., 26, 1418,1981 CIBHIE Cc R=0.0550 mC => mC 0.000 0.00 0.000 100% C2/c 5,10-Dihydro-5,10-dimethylphenazinium hexafluorophosphate C14 H14 N2 1+,F6 P1 1- K.Dietz,H.J.Keller,D.Nothe,D.Wehe Z.Naturforsch.,Teil B, 39, 452,1984 CIFHII Cc R=0.0350 mC => mC 0.000 0.00 0.000 97% C2/c 1,10-Dimethyl-7,16,21,26-tetraoxa-1,4,10,13-tetra-aza-tricyclo(11.5.5.5$4,10!)oc tacosane di-iodide hemihydrochloride hemihydrate at -130deg.C C22 H46 N4 O4 2+,C22 H47 N4 O4 3+,4(I1 1-),Cl1 1-,H2 O1 P.Groth Acta Chem.Scand.Ser.B, 38, 179,1984 CIRJOC Cc R=0.0750 mC => mC 0.000 0.00 0.000 83% C2/c tris(Quinolinium) tetrakis(1,1-dicyanoethylene-2,2-dithiolato)-molybdenum(v) C16 Mo1 N8 S8 3-,3(C9 H8 N1 1+) Yu Xiufen,Zhang Hanhui,Chen Duanhui Jiegou Huaxue(J.Struct.Chem.), 2, 251,1983 CIVLIC10 Cc R=0.0310 mC => oF 0.000 0.01 0.009 100% Fdd2 endo,exo-4,5-Dicarbomethoxyspiro(bicyclo(1.1.1)pentane-2,2'-(1, 3-dioxolane)) for stereoisomers see CIVLAU and CIVLEY, for re-interpretation in space group Fd d2 see R.E.Marsh, Acta Cryst.(B), 53,317,1997 (CIVLIC01) C11 H14 O6 H.Irngartinger,W.Reimann,P.Garner,P.Dowd J.Org.Chem., 53, 3046,1988 CIWKEY01 Cc R=0.0220 mC => mC 0.000 0.00 0.000 87% C2/c Tetrapyridine-platinum(ii) dichloride trihydrate combined neutron xray study C20 H20 N4 Pt1 2+,2(Cl1 1-),3(H2 O1) Chin Hsuan Wei,B.E.Hingerty,W.R.Busing Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 45, 26,1989 CIWROP Cc R=0.0680 mC => mC 0.000 0.00 0.000 90% C2/c Triphenyl-(triphenylphosphoranylideneamino)phosphonium phenylcyanophosphide at -25 deg.C C36 H30 N1 P2 1+,C7 H5 N1 P1 1- A.Schmidpeter,K.-H.Zirzow,G.Burget,G.Huttner,I.Jibril Chem.Ber., 117, 1695,1984 CLESMO Cc R=0.0410 mC => mC 0.000 0.00 0.000 100% C2/c Tetrachloro-tetrakis(diethylsulfide)-di-molybdenum(ii) C16 H40 Cl4 Mo2 S4 F.A.Cotton,P.E.Fanwick Acta Crystallogr.,Sect.B, 36, 457,1980 CLIPPB10 Cc R=0.0560 mC => mC 0.000 0.00 0.000 96% C2/c trans-Chloro-(1-isopropenylvinyl)-bis(triphenylphosphine) platinum(ii) benzene s olvate C41 H37 Cl1 P2 Pt1,C6 H6 A.Furlani,M.V.Russo,A.C.Villa,A.G.Manfredotti,C.Guastini J.Chem.Soc.,Dalton Trans., , 2154,1977 CLPTSX Cc R=0.0580 mC => mC 0.000 0.00 0.000 94% C2/c 1,3-bis(4-Chlorophenyl)trisulfane-2-oxide C12 H8 Cl2 O1 S3 R.Steudel,P.Luger,H.Bradaczek Chem.Ber., 110, 3553,1977 CLTPNN01 Cc R=0.0800 mC => mC 0.000 0.00 0.000 94% C2/c Chloro-nitrosyl-bis(triphenylphosphine)-nickel benzene solvate space group no.9 C36 H30 Cl1 N1 Ni1 O1 P2,C6 H6 K.J.Haller,J.H.Enemark Inorg.Chem., 17, 3552,1978 CLTPOC Cc R=0.1100 mC => oF 0.000 0.03 0.017 100% Fdd2 Dichloro-bis(triphenylphosphine oxide)-cobalt(ii) for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CLTPOC02). C36 H30 Cl2 Co1 O2 P2 M.M.Mangion,R.Smith,S.G.Shore Cryst.Struct.Commun., 5, 493,1976 COKJAN Cc R=0.0473 mC => mC 0.000 0.00 0.000 81% C2/c trans-Aqua-chloro-((1S,4S,7S,8R,11R,14R)-5,5,7e,12,12,14e-hexamethyl-1,4,8,11-te tra-azacyclotetradecane)-chromium(iii) dinitrate C16 H38 Cl1 Cr1 N4 O1 2+,2(N1 O3 1-) R.Temple,D.A.House,W.T.Robinson Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 40, 1789,1984 CPHPNB B11b R=0.0900 mB => mC 0.000 0.00 0.000 96% C2/c (pi-Cyclopentadienyl)-bis(triphenylphosphine)-niobium carbonyl dihydride C42 H37 Nb1 O1 P2 N.I.Kirillova,A.I.Gusev,A.A.Pasynskii,Yu.T.Struchkov Zh.Strukt.Khim., 15, 288,1974 CPOECU10 Cc R=0.0710 mC => mC 0.000 0.00 0.000 100% C2/c Trichloro((2-(diphenylphosphinyl)ethyl)dimethylammonium)-copper(ii) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CPOECU01). C16 H21 Cl3 Cu1 N1 O1 P1 M.G.Newton,H.D.Caughman,R.C.Taylor J.Chem.Soc.,Dalton Trans., , 1031,1974 CPPYMO10 Cc R=0.0350 mC => mC 0.000 0.00 0.000 100% C2/c bis(Cyclopentadienyl)biphosphino-molybdenum C10 H12 Mo1 P2 E.Cannillo,A.Coda,K.Prout,J.-C.Daran Acta Crystallogr.,Sect.B, 33, 2608,1977 CTETEC Cc R=0.0530 mC => mC 0.000 0.00 0.000 100% C2/c Cyclotetraeicosane at -160 deg.C C24 H48 P.Groth Acta Chem.Scand.Ser.A, 33, 199,1979 CTPIRA Ia R=0.0250 mI => hR 0.002 0.00 0.029 100% R3c fac-Trichloro-tris(dimethylphenylphosphine)-iridium(iii) for stereoisomer see CTPIRC, for re-interpretation in space group R3c see R.E.Ma rsh, Acta Cryst.(B), 53,317,1997 (CTPIRA01) C24 H33 Cl3 Ir1 P3 G.B.Robertson,P.A.Tucker Acta Crystallogr.,Sect.B, 37, 814,1981 CUACPY Cc R=0.1480 mC => mC 0.000 0.00 0.000 100% C2/c bis((Acetato)-pyridine)-copper pyridine solvate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CUACPY01) C14 H16 Cu1 N2 O4,C5 H5 N1 K.Anzenhofer,L.N.A.ten Rouwelaar Rec.Trav.Chim.Pays-Bas(Rec.J.R.Neth.Chem.Soc.), 86, 801,1967 CUHAPT Cc R=0.0930 mC => mC 0.000 0.00 0.000 100% C2/c bis(2-Hydroxyacetophenone)trimethylenedi-imino-copper(ii) for re-refinement see Kapon and Reisner, Acta Cryst.,C46,349,1990 C19 H20 Cu1 N2 O2 K.Iida,I.Oonishi,A.Nakahara,Y.Komiyama Bull.Chem.Soc.Jpn., 43, 2347,1970 CUSYUK Fd11 R=0.0260 mF => oF 0.000 0.40 0.242 90% Fdd2 Sodium triaqua-ethylenediaminetetra-acetato-holmium(ii) pentahydrate C10 H18 Ho1 N2 O11 1-,Na1 1+,5(H2 O1) L.K.Templeton,D.H.Templeton,A.Zalkin Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 41, 355,1985 CUWSES Cc R=0.0360 mC => mC 0.000 0.00 0.000 100% C2/c (mu!2$-Tetraphenyldiphosphoxane-P,P')-bis(pentacarbonyl-chromium(0)) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (CUWSES01). C34 H20 Cr2 O11 P2 C.Zeiher,J.Mohyla,I.-P.Lorenz,W.Hiller J.Organomet.Chem., 286, 159,1985 CYPEIN01 Cc R=0.0420 mC => mC 0.000 0.00 0.000 100% C2/c catena((mu!2$-eta$10!-Cyclopentadienyl)-indium(i)) (C10 H10 In2)n O.T.Beachley Junior,J.C.Pazik,T.E.Glassman,M.R.Churchill,J.C.Fettinger,R.Blom Organometallics, 7, 1051,1988 DAPSMN Ia R=0.0390 mI => mC 0.000 0.00 0.000 85% C2/c Aqua-chloro-(2,6-diacetylpyridine-bis(semicarbazone))-manganese(ii) chloride dih ydrate C11 H17 Cl1 Mn1 N7 O3 1+,Cl1 1-,2(H2 O1) G.J.Palenik,D.W.Wester Inorg.Chem., 17, 864,1978 DAWDIO Cc R=0.0510 mC => mC 0.000 0.00 0.000 100% C2/c 1,1,2,2-Tetraisopropyl-3,3,4,4-tetraneopentyl-cyclotetrasilane for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DAWDIO01). C32 H72 Si4 H.Matsumoto,K.Takatsuna,M.Minemura,Y.Nagai,M.Goto J.Chem.Soc.,Chem.Comm., , 1366,1985 DAWWED Cc R=0.0450 mC => mC 0.000 0.00 0.000 89% C2/c bis(Tetramethylammonium) ethyl-pentachloro-tin for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DAWWED01) C2 H5 Cl5 Sn1 2-,2(C4 H12 N1 1+) K.A.Paseshnitchenko,L.A.Aslanov,A.V.Jatsenko,S.V.Medvedev J.Organomet.Chem., 287, 187,1985 DAWWIH Cc R=0.0600 mC => mC 0.000 0.00 0.000 100% C2/c bis(Tetramethylammonium) t-butyl-pentabromo-tin for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DAWWIH01) C4 H9 Br5 Sn1 2-,2(C4 H12 N1 1+) K.A.Paseshnitchenko,L.A.Aslanov,A.V.Jatsenko,S.V.Medvedev J.Organomet.Chem., 287, 187,1985 DELWEW Cc R=0.0460 mC => oF 0.000 0.08 0.016 100% Fdd2 2,6-Dimethyl-4,8-diphenyl-2,4,6,8-tetra-aza-1,5-diphosphabicyclo(3.3.1)nonane-3, 7-dione for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DELWEW01) C17 H18 N4 O2 P2 R.Neidlein,H.-J.Degener,A.Gieren,G.Weber,T.Hubner Z.Naturforsch.,Teil B, 40, 1532,1985 DERKOA10 Cc R=0.0440 mC => mC 0.000 0.00 0.000 91% C2/c tris(Tetraethylammonium) bis(bis(mu!2$-sulfido)-(ethane-1,2-dithiolato-S,S')-sul fido-molybdenum)-iron for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DERKOA02) C4 H8 Fe1 Mo2 S10 3-,3(C8 H20 N1 1+) Wang Fengshan,Zhang Zhigui,Fan Yuguo,Shen Cheng Jilin Daxue Ziran Kex.Xue., , 94-2,1984 DESZUW Cc R=0.0380 mC => hR 0.008 0.02 0.016 100% R3c tris(2-Furyl)-phosphine-selenide for re-interpretation in space group R3c see R.E.Marsh, Acta Cryst.(B), 53,317,1 997 (DESZUW01). C12 H9 O3 P1 Se1 D.W.Allen,I.N.Nowell,B.F.Taylor J.Chem.Soc.,Dalton Trans., , 2505,1985 DEWMAT Cc R=0.0590 mC => mC 0.000 0.00 0.000 100% C2/c Bromo-methyl-bis(mu!2$-diphenyldimethylenephosphoranyl-C,C')-di-gold(ii) C29 H31 Au2 Br1 P2 J.D.Basil,H.H.Murray,J.P.Fackler Junior,J.Tocher,A.M.Mazany,B.Trzcinska-Bancroft ,H.Knachel,D.Dudis,T.J.Delord,D.O.Marler J.Am.Chem.Soc., 107, 6908,1985 DIBKEE Cc R=0.0833 mC => mC 0.000 0.00 0.000 95% C2/c 8-Hydroxyquinolinium bis((tris(8-quinolinato)-dihydrogen-N,O)-nickel(ii)) bis((t ris(8-quinolinato)-hydrogen-N,O)-nickel(ii)) triperchlorate 2(C27 H20 N3 Ni1 O3 1+),2(C27 H19 N3 Ni1 O3),C9 H8 N1 O1 1+,3(Cl1 O4 1-) H.Kiriyama,Y.Yamagata,K.Yonetani,E.Sekido Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 42, 56,1986 DIBROV Cc R=0.0309 mC => mC 0.000 0.00 0.000 100% C2/c Dichloro-(ethylene-bis(eta$5!,eta$5!-4,5,6,7-tetrahydro-(R,S)-1-indenyl))-zircon ium(iv) at 228 deg.K, for stereoisomer (meso) see VIXYEG C20 H24 Cl2 Zr1 F.R.W.P.Wild,M.Wasiucionek,G.Huttner,H.H.Brintzinger J.Organomet.Chem., 288, 63,1985 DIKWAV Cc R=0.0600 mC => mC 0.000 0.00 0.000 86% C2/c Dichloro-tetrakis(t-butyl-isocyanide)-di-palladium(i) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DIKWAV01). C20 H36 Cl2 N4 Pd2 Y.Yamamoto,H.Yamazaki Bull.Chem.Soc.Jpn., 58, 1843,1985 DIOXGC Cc R=0.1320 mC => mC 0.000 0.00 0.000 100% C2/c 1,4-Dioxane dichloro-germanium for re-interpretation in space group C2/c see DIOXGC01 C4 H8 O2,Cl2 Ge1 V.I.Kulishov,N.G.Bokii,Yu.T.Struchkov,O.M.Nefedov,S.P.Kolesnikov,B.M.Perl'mutter Zh.Strukt.Khim., 11, 71,1970 DIRVEF Cc R=0.0540 mC => mC 0.000 0.00 0.000 100% C2/c bis((mu!2$-t-Butylthiolato)-bis(mu!3$-sulfido)-bis(eta$5!-methylcyclopentadienyl )-di-chromium)-manganese for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DIRVEF01) C32 H46 Cr4 Mn1 S6 A.A.Pasynskii,I.L.Eremenko,G.Sh.Gasanov,Yu.T.Struchkov,V.E.Shklover J.Organomet.Chem., 276, 349,1984 DIRVIJ Cc R=0.0450 mC => mC 0.000 0.00 0.000 100% C2/c bis((mu!2$-t-Butylthiolato)-bis(mu!3$-sulfido)-bis(eta$5!-methyl-cyclopentadieny l)-di-chromium)-iron for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DIRVIJ01) C32 H46 Cr4 Fe1 S6 A.A.Pasynskii,I.L.Eremenko,G.Sh.Gasanov,Yu.T.Struchkov,V.E.Shklover J.Organomet.Chem., 276, 349,1984 DISCAJ Cc R=0.0690 mC => mC 0.000 0.00 0.000 94% C2/c bis(N-Tritylurea) N,N-dimethylformamide clathrate at 115 deg.K 2(C20 H18 N2 O1),C3 H7 N1 O1 I.Goldberg,Lon-Tang W.Lin,H.Hart J.Inclusion Phenom., 2, 377,1984 DISKEV B11b R=0.0520 mB => mC 0.000 0.00 0.000 94% C2/c 3,9-Dimethyl-6,14,17,22,25-pentaoxa-1,3,9,11-tetra-azabicyclo(9. 8.8)heptacosane -2,10-dione for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DISKEV01) C20 H38 N4 O7 A.A.Dvorkin,Yu.A.Simonov,N.G.Luk'yanenko,T.I.Kirichenko,S.V.Shcherbakov,T.I.Mali novskii,A.V.Bogatskii Kristallografiya, 30, 915,1985 DISXAE Cc R=0.0730 mC => mC 0.000 0.00 0.000 81% C2/c catena-Aqua-bis((2,3,4,5-tetrahydro-2,6-diphenyl-1,2,4-triazin-4-yl)-acetato-O,N $4!)-copper(ii) dihydrate (C34 H34 Cu1 N6 O5)n,2n(H2 O1) Soon-Beng Teo,Siang-Guan Teoh,T.W.Hambley,M.R.Snow J.Chem.Soc.,Dalton Trans., , 553,1986 DIWTIM Cc R=0.0930 mC => mC 0.000 0.00 0.000 91% C2/c Diphenylmethyl-bis(bis(trimethylsilyl)-methylene)-phosphorane C27 H47 P1 Si4 R.Appel,E.Gaitzsch,K.-H.Dunker,F.Knoch Chem.Ber., 119, 535,1986 DLMALC Cc R=0.0550 mC => mC 0.000 0.00 0.000 89% C2/c (+-)-Malic acid alpha form, Cc form, for stereoisomer (-) see COFRUK C4 H6 O5 J.F.J.van Loock,M.van Havere,A.T.H.Lenstra Bull.Soc.Chim.Belg., 90, 161,1981 DOBJIN Cc R=0.0420 mC => mC 0.000 0.00 0.000 100% C2/c catena-Tetra-aqua-(mu!2$-squarato-O,O')-zinc space group Cc. (C8 H16 O16 Zn2)n A.Weiss,E.Riegler,I.Alt,H.Bohme,C.Robl Z.Naturforsch.,Teil B, 41, 18,1986 DOHVOL Cc R=0.0810 mC => mC 0.000 0.00 0.000 86% C2/c Octaneopentyl-cyclotetrasilane for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DOHVOL01) C40 H88 Si4 H.Matsumoto,M.Minemura,K.Takatsuna,Y.Nagai,M.Goto Chem.Lett., , 1005,1985 DOHXIH Aa R=0.0480 mA => mC 0.000 0.00 0.000 90% C2/c Tetraethylammonium ((1RS,4RS,8SR,11SR)-1,4,8,11-tetramethyl-1,4,8,11-tetra-azacy clotetradecane-N$1!,N$4!,N$8!,N$11!)-bis(monomethyl-carbonato-O)-nickel(ii ) perchlorate C18 H38 N4 Ni1 O6,C6 H16 N1 1+,Cl1 O4 1- M.Kato,T.Ito Bull.Chem.Soc.Jpn., 59, 285,1986 DOKLOE Cc R=0.0820 mC => hR 0.002 0.01 0.102 96% R3c (tris(mu!2$-5-Methyl-isophthalaldehyd-2-olato)-N,N'-bis(mu!3$-tris(aminoethyl)-a mine)-N,N',N'',O,O)-cobalt-iron tetrafluoroborate for re-refinement in space group R-3c see Marsh and Schaefer, Inorg. Chem.,25,36 61,1986 C39 H45 Co1 Fe1 N8 O3 1+,B1 F4 1- M.D.Timken,W.A.Marritt,D.N.Hendrickson,R.A.Gagne,E.Sinn Inorg.Chem., 24, 4202,1985 DOTJIF Cc R=0.0390 mC => mC 0.000 0.00 0.000 100% C2/c (Benzoylbenzophenato)-tetrachloro-antimony(v) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DOTJIF01) C15 H11 Cl4 O2 Sb1 C.Gerard,E.A.C.Lucken,G.Bernardinelli J.Chem.Soc.,Perkin Trans.2, , 879,1986 DUNPEH Cc R=0.0696 mC => mC 0.000 0.00 0.000 100% C2/c bis(mu!2$-Carbonyl)-hexacarbonyl-bis(mu!2$-hydrido)-tetrakis(mu!2$-di-t-butylpho sphino-P,P)-hexa-rhodium for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (DUNPEH01) C40 H74 O8 P4 Rh6 A.M.Arif,D.E.Heaton,R.A.Jones J.Chem.Soc.,Chem.Comm., , 1506,1986 DURWOC Cc R=0.0787 mC => mC 0.000 0.00 0.000 98% C2/c bis((mu!2$-Imidazolato-N,N')-penta-ammine-cobalt(iii))-tetra-ammine-cobalt(iii) dichloride hydroxide dithionate hydrate C6 H48 Co3 N18 7+,2(O6 S2 2-),2(Cl1 1-),H1 O1 1-,3.5(H2 O1) C.J.Hawkins,E.Horn,J.Martin,J.A.L.Palmer,M.R.Snow Aust.J.Chem., 39, 1213,1986 DUYGAF Cc R=0.0940 mC => hR 0.028 0.06 0.146 100% R3c Triphenylcyclopropenylium tris(mu!2$-bromo)-bis((eta$3!-triphenylcyclopropenyl)- nickel) for re-interpretation in space group R3c see R.E.Marsh, Acta Cryst.(B), 53,317,1 997 (DUYGAF01). C42 H30 Br3 Ni2 1-,C21 H15 1+ F.Cecconi,C.A.Ghilardi,S.Midollini,S.Moneti,A.Orlandini Angew.Chem.,Int.Ed.Engl., 25, 833,1986 EAFMOT Cc R=0.0610 mC => mC 0.000 0.00 0.000 83% C2/c Tetraethylammonium tetrafluoro(2-methylpyridine N-oxide) peroxotantalum(v) C6 H7 F4 N1 O3 Ta1 1-,C8 H20 N1 1+ J.C.Dewan,A.J.Edwards,J.Y.Calves,J.E.Guerchais J.Chem.Soc.,Dalton Trans., , 981,1977 ENTCOF Cc R=0.0360 mC => mC 0.000 0.00 0.000 81% C2/c (Methyl 2-aminoethyl thioether)-bis(ethylenediamine) cobalt(iii) hexacyano-iron( iii) tetrahydrate C7 H25 Co1 N5 S1 3+,C6 Fe1 N6 3-,4(H2 O1) R.C.Elder,G.J.Kennard,M.D.Payne,E.Deutsch Inorg.Chem., 17, 1296,1978 FAKRIS01 Cc R=0.1240 mC => mC 0.000 0.00 0.000 100% C2/c (E)-Acetophenone oxime monoclinic beta form, for stereoisomer see FAKROY, for redetermination in C2/c s ee FAKRIS02 C8 H9 N1 O1 A.Gieren,T.Hubner,C.Ruiz-Perez Chem.Zeit., 110, 73,1986 FAWBAG Cc R=0.0800 mC => mC 0.000 0.00 0.000 100% C2/c bis(Pyridoxylidene-tryptamine-N,O)-copper(ii) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (FAWBAG01). C36 H36 Cu1 N6 O4 T.Ishida,K.-I.Hatta,S.Yamashita,M.Doi,M.Inoue Chem.Pharm.Bull., 34, 3553,1986 FAXTUT Cc R=0.0370 mC => oF 0.000 0.00 0.019 100% Fdd2 trans-4-(1-Hydroxyisopropyl)-1-methylcyclohexan-1-ol monohydrate trans-Terpin monohydrate for reinterpretation and re-refinement see Marsh and Herbstein, Acta Cryst.,B44, 77,1988 C10 H20 O2,H2 O1 Tong-Ing Ho,Ming-Chu Cheng,Shie-Ming Peng,Fa-Ching Chen,Chi-Chin Tsau Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 42, 1787,1986 FDAPSC10 Ia R=0.0400 mI => mC 0.000 0.00 0.000 85% C2/c Aqua-chloro-(2,6-diacetylpyridine-bis(semicarbazone))-iron(ii) chloride dihydrat e C11 H17 Cl1 Fe1 N7 O3 1+,Cl1 1-,2(H2 O1) G.J.Palenik,D.W.Wester Inorg.Chem., 17, 864,1978 FENNUH Cc R=0.0290 mC => mC 0.000 0.00 0.000 100% C2/c C,C-bis(Dimethylamino)methylene-phosphine at -110 deg.C C5 H13 N2 P1 A.N.Chernega,M.Yu.Antipin,Yu.T.Struchkov,T.V.Sarina,V.D.Romanenko Zh.Strukt.Khim., 27, 78-5,1986 FEXJOH Cc R=0.0667 mC => oF 0.000 0.04 0.077 100% Fdd2 (mu!2$-Di-t-butylphosphido-P,P)-(di-t-butylphosphido-P)-(mu!2$-carbonyl)-dicarbo nyl-(eta$4!-1,5-cyclo-octadiene)-iron-rhodium C27 H49 Fe1 O3 P2 Rh1 A.M.Arif,D.J.Chandler,R.A.Jones Organometallics, 6, 506,1987 FEXVAF Cc R=0.0700 mC => oF 0.000 0.02 0.088 100% Fdd2 tris(Trimethylsilyl-methylphosphino)-phosphane at -60 deg.C for re-refinement see Kapon and Reisner, Acta Cryst.,C46,349,1990 C12 H36 P4 Si3 G.Fritz,K.Stoll,W.Honle,H.G.von Schnering Z.Anorg.Allg.Chem., 544, 127,1986 FIXWIS Cc R=0.0270 mC => oF 0.000 0.04 0.010 100% Fdd2 9,10-Dihydro-4,5-dimethoxyphenanthrene for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (FIXWIS01). C16 H16 O2 R.Cosmo,T.W.Hambley,S.Sternhell J.Org.Chem., 52, 3119,1987 FNPHPB Cc R=0.0760 mC => mC 0.000 0.00 0.000 86% C2/c (2-Fluoro-4-nitrosophenolato) triphenyl-lead (C48 H36 F2 N2 O4 Pb2)n N.G.Bokii,A.I.Udel'nov,Yu.T.Struchkov,D.N.Kravtsov,V.M.Pacherskaya Zh.Strukt.Khim., 18, 1025,1977 FOJBOV Cc R=0.0800 mC => mC 0.000 0.00 0.000 100% C2/c Pentacarbonyl-iron at -80 deg.C for redetermination see Donohue and Caron, Acta Cryst.,17,663,1964 C5 Fe1 O5 A.W.Hanson Acta Crystallogr., 15, 930,1962 FPCLET Cc R=0.0950 mC => mC 0.000 0.00 0.000 100% C2/c 1,1-Dichloro-2,2-bis(p-fluorophenyl)ethane C14 H10 Cl2 F2 G.Smith,C.H.L.Kennard,J.Whitnall Cryst.Struct.Commun., 6, 131,1977 FUZYII Cc R=0.0530 mC => mC 0.000 0.00 0.000 100% C2/c bis(Tetraethylammonium) hexaoxo-(mu!6$-sulfido)-hexakis(mu!3$-disulfido)-hexakis (mu!3$-sulfido)-hexa-copper-hexa-molybdenum dimethylformamide solvate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (FUZYII01) 2(C8 H20 N1 1+),Cu6 Mo6 O6 S19 2-,C3 H7 N1 O1 Wu Xintao,Wang Bing,Zheng Yifan,Lu Jiaxi Jiegou Huaxue(J.Struct.Chem.), 7, 47,1988 GANHAE Ia R=0.0500 mI => oI 0.000 0.02 0.044 100% Ima2 4-Phenyl-1,2-dithiolium tri-iodide C9 H7 S2 1+,I3 1- A.Hordvik,K.Jynge,L.K.Hansen Acta Chem.Scand.Ser.A, 42, 79,1988 GAVFUE Cc R=0.1000 mC => mC 0.000 0.00 0.000 94% C2/c Carbonyl-chloro-(dithiocinnamato-S,S')-bis(triphenylphosphine)-ruthenium C46 H37 Cl1 O1 P2 Ru1 S2 M.R.Torres,A.Perales,J.Ros Organometallics, 7, 1223,1988 GAVWIJ Cc R=0.0377 mC => oF 0.000 0.64 0.212 100% Fdd2 (mu!2$-Acetato-O,O')-bis(mu!2$-oxo)-dichloro-bis(2,2'-bipyridine-N,N')-di-mangan ese(iii,iv) acetonitrile solvate at -155 deg.C C22 H19 Cl2 Mn2 N4 O4,2(C2 H3 N1) J.S.Bashkin,A.R.Schake,J.B.Vincent,H.-R.Chang,Qiaoying Li,J.C.Huffman,G.Christou ,D.N.Hendrickson J.Chem.Soc.,Chem.Comm., , 700,1988 GAXDAK10 Cc R=0.0590 mC => mC 0.000 0.00 0.000 95% C2/c (eta$2!-N,N-Dimethylcarbamoyl-C,O)-hydrido-bis(bis(diphenylphosphino)ethane)-tun gsten C55 H55 N1 O1 P4 W1 T.Ishida,Y.Mizobe,T.Tanase,M.Hidai J.Organomet.Chem., 409, 355,1991 GAXVOQ Cc R=0.0270 mC => mC 0.000 0.00 0.000 100% C2/c (eta$4!-Cyclo-octa-1,5-diene)-bis(2-methoxymethyl-6-methylphenyl)-platinum(ii) at -100 deg.C for revised structure see Kapon and Reisner, Acta Cryst.,C46,349,1 990 C26 H34 O2 Pt1 T.Debaerdemaeker,R.Baumgartner,H.-A.Brune Z.Kristallogr., 180, 171,1987 GEGXEV Cc R=0.0433 mC => mC 0.000 0.00 0.000 100% C2/c (+-)-(4aR*,4bS*,8aS*,10aS*)-10a-((Methoxymethoxy)methyl)-8a-(2-methoxy-2-oxoethy l)perhydrophenanthren-9-one for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (GEGXEV01) C20 H32 O5 A.G.Schultz,M.Macielag,D.E.Podhorez,J.C.Suhadolnik,R.K.Kullnig J.Org.Chem., 53, 2456,1988 GEJMAJ Cc R=0.0560 mC => mC 0.000 0.00 0.000 95% C2/c bis(mu!2$-Pyrogallol)-bis(bis(acetylacetonato-O,O')-vanadium(iii)) toluene solva te for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (GEJMAJ01) C32 H38 O14 V2,C7 H8 S.Lee,K.Nakanishi,M.Y.Chiang,R.B.Frankel,K.Spartalian J.Chem.Soc.,Chem.Comm., , 785,1988 GUPCCE B11b R=0.0720 mB => mC 0.000 0.00 0.000 100% C2/c Guanidinium pentacarbonato-cerium(iv) tetrahydrate for reinterpretation and re-refinement see Marsh and Herbstein, Acta Cryst.,B44, 77,1988 6(C1 H6 N3 1+),C5 Ce1 O15 6-,4(H2 O1) S.Voliotis,A.Rimsky,J.Faucherre Acta Crystallogr.,Sect.B, 31, 2607,1975 GUPCTH B11b R=0.0620 mB => mC 0.000 0.00 0.000 100% C2/c Guanidinium pentacarbonato-thorium(iv) tetrahydrate for reinterpretation see Marsh and Herbstein, Acta Cryst.,B44,77,1988 6(C1 H6 N3 1+),C5 O15 Th1 6-,4(H2 O1) S.Voliotis,A.Rimsky Acta Crystallogr.,Sect.B, 31, 2612,1975 *SPGN=9 // HABKAW Cc R=0.0230 mC => mC 0.000 0.00 0.000 100% C2/c Isobutanol-isobutoxy-triphenyl-tin(iv) at 213 deg.K C26 H34 O2 Sn1 H.Reuter,D.Schroder Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 49, 954,1993 HACXIS Cc R=0.0560 mC => mC 0.000 0.00 0.000 92% C2/c (mu!2$-Cyano)-isoselenocyanato-tris(1,10-phenanthroline)-di-copper(i,ii) (mu!2$- cyano)-isocyanato-tris(1,10-phenanthroline)-di-copper(i,ii) isoselenocyana te isothiocyanate ethanol solvate 0.65(C38 H24 Cu2 N8 Se1 1+),0.45(C38 H24 Cu2 N8 S1 1+),0.65(C1 N1 Se1 1-),0.45(C 1 N1 S1 1-),0.5(C2 H6 O1) M.Dunaj-Jurco,M.Kabesova,V.Kettmann,I.Cisarova,D.Miklos Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 49, 1476,1993 HAGTIS B11b R=0.0880 mB => mC 0.000 0.00 0.000 100% C2/c Cesium bis(citrato)borate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (HAGTIS01) C12 H12 B1 O14 1-,Cs1 1+ I.Zviedre,V.Fundamensky,E.Schwartz Latv.Khim.Zh., , 527,1992 HALJUZ Ia R=0.0740 mI => mC 0.000 0.00 0.000 100% C2/c 1,3,5-Tri-isopropyl-2-nitrobenzene at 253 deg.K, for redetermination in space group C2/c see R.E.Marsh, Acta Cryst. (B), 53,317,1997 (HALJUZ01) C15 H23 N1 O2 D.J.A.De Ridder,H.Schenk,D.Dopp Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 49, 1970,1993 HAXJIZ Cc R=0.0660 mC => mC 0.000 0.00 0.000 100% C2/c Diaqua-(1,6-bis(benzimidazol-2-yl)-2,5-dithiahexane)-cobalt(ii) dinitrate monohy drate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (HAXJIZ01) C18 H22 Co1 N4 O2 S2 2+,2(N1 O3 1-),H2 O1 R.Carballo,A.Castineiras J.Crystallogr.Spectrosc.Res., 23, 891,1993 HAZDNI Cc R=0.0620 mC => mC 0.000 0.00 0.000 94% C2/c Acetylacetonato-C-meso-(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetra-aza-cyclotetrad ecane) nickel(ii) perchlorate C21 H43 N4 Ni1 O2 1+,Cl1 O4 1- N.F.Curtis,D.A.Swann,T.N.Waters J.Chem.Soc.,Dalton Trans., , 1408,1973 HEDKAC Cc R=0.0450 mC => mC 0.000 0.00 0.000 100% C2/c (N,N'-bis(4-Methoxyphenyl)tetraglycollic diamido)-tris(nitrato-O, O')-praseodymi um acetonitrile solvate C22 H28 N5 O16 Pr1,2(C2 H3 N1) Xinmin Gan,Zhijian Liang,Ning Tang,Minyu Tan,Kaibei Yu,Ganzu Tan Polyhedron, 12, 1927,1993 HYZMAC Cc R=0.0920 mC => mC 0.000 0.00 0.000 100% C2/c Hydrazinium acetate C2 H3 O2 1-,H5 N2 1+ S.A.Hady,I.Nahringbauer,I.Olovsson Acta Chem.Scand., 23, 2764,1969 IBPBAC Cc R=0.0590 mC => mC 0.000 0.00 0.000 100% C2/c Isobutyl-4-(4'-phenylbenzylideneamino)-cinnamate C26 H25 N1 O2 A.J.Leadbetter,M.A.Mazid,K.M.A.Malik Mol.Cryst.Liq.Cryst., 61, 39,1980 IMCYLP10 Ia R=0.0420 mI => aP 0.000 0.00 0.000 100% P1 8,16-Imino-cis(2.2)metacyclophane at -160 deg.C C16 H15 N1 A.W.Hanson,K.Huml Acta Crystallogr.,Sect.B, 27, 459,1971 INOLPT Cc R=0.0780 mC => mC 0.000 0.00 0.000 100% C2/c (2,2'-Bi(indan-1,3-dione)-2,2'-diolato)-bis(triphenylphosphine)-platinum for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (INOLPT01). C54 H38 O6 P2 Pt1 M.M.Hunt,R.D.W.Kemmitt,D.R.Russell,P.A.Tucker J.Chem.Soc.,Dalton Trans., , 287,1979 INTRBE Aa R=0.1200 mA => mC 0.000 0.00 0.000 89% C2/c p-Iodonitrosobenzene C6 H4 I1 N1 O1 M.S.Webster J.Chem.Soc., , 2841,1956 IPDTPN B11b R=0.1000 mB => mC 0.000 0.00 0.000 100% C2/c bis(O,O'-Di-isopropyldithiophosphato) nickel(ii) C12 H28 Ni1 O4 P2 S4 V.V.Tkachev,L.O.Atovmyan Koord.Khim., 2, 997,1976 JABJOL Cc R=0.0519 mC => mC 0.000 0.00 0.000 100% C2/c cis-bis(Acetylacetonato-O,O')-(N,N,N',N'-tetraethylethylenediamine)-cobalt for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (JABJOL01). C20 H38 Co1 N2 O4 R.E.Colborn,M.F.Garbauskas,C.I.Hejna Inorg.Chem., 27, 3661,1988 JAFZAR Cc R=0.0408 mC => mC 0.000 0.00 0.000 87% C2/c (mu!2$-Oxo)-(mu!2$-telluro)-bis(bis(eta$5!-t-butyl-cyclopentadienyl)-zirconium) C36 H52 O1 Te1 Zr2 G.Erker,R.Nolte,G.Tainturier,A.Rheingold Organometallics, 8, 454,1989 JAHRAL Cc R=0.0280 mC => mC 0.000 0.00 0.000 97% C2/c bis(1,4,5,8-Tetra-azaphenanthrene-N,N')-silver(i) nitrate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (JAHRAL01). C20 H12 Ag1 N8 1+,N1 O3 1- J.Nasielski,R.Nasielski-Hinkens,S.Heliporn,C.Rypens,J.P.Declercq Bull.Soc.Chim.Belg., 97, 983,1988 JANNOB Cc R=0.0410 mC => mC 0.000 0.00 0.000 91% C2/c (N,N'-bis(2-(Diphenylphosphino)phenyl)propane-1,3-diamine)-carbonyl-chloro-rhodi um(i) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (JANNOB01). C40 H36 Cl1 N2 O1 P2 Rh1 M.K.Cooper,P.A.Duckworth,T.W.Hambley,G.J.Organ,K.Henrick,M.McPartlin,A.Parekh J.Chem.Soc.,Dalton Trans., , 1067,1989 JASLIY Cc R=0.0250 mC => mC 0.000 0.00 0.000 100% C2/c Chloro-bis(dihydrobis(pyrazolyl)borate-N,N')-gallium(iii) for corrigendum see Marsh, Inorg.Chem., 29,1449,1990 C12 H16 B2 Cl1 Ga1 N8 D.L.Reger,S.J.Knox,L.Lebioda Inorg.Chem., 28, 3092,1989 JECFOM Aa R=0.1040 mA => mC 0.000 0.00 0.000 100% C2/c 2,2'-Dicyano-5,5'-dimethyl-biphenyl C16 H12 N2 Kyungsoo Paek,C.B.Knobler,E.F.Maverick,D.J.Cram J.Am.Chem.Soc., 111, 8662,1989 JEGGIL Cc R=0.0420 mC => mC 0.000 0.00 0.000 100% C2/c 1,3-Dimethyl-2,4,10,11,13-pentaoxa-1,3-disilatetracyclo(6.2.2.2$3,6!.0$6,8!)tetr adecane for stereoisomer see JEGGEH, for re-interpretation in space group C2/c see R.E.M arsh, Acta Cryst.(B), 53,317,1997 (JEGGIL01) C9 H16 O5 Si2 B.de Ruiter,J.E.Benson,R.A.Jacobson,J.G.Verkade Inorg.Chem., 29, 1065,1990 JEVTOT Cc R=0.0388 mC => mC 0.000 0.00 0.000 100% C2/c Diaqua-bis(mu!2$-picolinaldehyde N-oxide-2-thiosemicarbazonato-O,O,N',S)-di-copp er(ii) dinitrate monohydrate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (JEVTOT01) C14 H18 Cu2 N8 O4 S2 2+,2(N1 O3 1-),H2 O1 Lu Qin,Wang Guo-Xiong,Zang Yan,Yin Zhan-Feng,Zheng Cheng,Zhou Zhong-Yuan Huaxue Xuebao(Acta Chim.Sinica)(Chin.), 47, 1065,1989 JIMSEC Cc R=0.0586 mC => mC 0.000 0.00 0.000 82% C2/c trans-Aqua-carbonyl-bis(triphenylphosphine)-rhodium trifluoromethanesulfonate C37 H32 O2 P2 Rh1 1+,C1 F3 O3 S1 1- P.J.Stang,Linsheng Song,Yo-Hsin Huang,A.M.Arif J.Organomet.Chem., 405, 403,1991 JISKEB Cc R=0.0630 mC => tI 0.001 0.02 0.214 100% I-4c2 bis(mu!2$-Hydroxo)-tris(trimethyl-tin) iodide for re-interpretation in space group I-4c2 see R.E.Marsh, Acta Cryst.(B), 53,317 ,1997 (JISKEB01) C9 H29 O2 Sn3 1+,I1 1- E.G.Perevalova,M.D.Reshetova,P.N.Ostapchuk,Yu.L.Slovokhotov,Yu.T.Struchkov,F.M.S piridonov,A.V.Kisin,I.G.Yukhno Metalloorg.Khim.(Organometallic Chem.in USSR), 3, 100,1990 JOGVUW Aa R=0.0500 mA => oF 0.000 0.04 0.026 100% Fdd2 Ammonium aqua-(ethylenediamine-N,N,N',N'-tetra-acetato)-vanadium(iii) hydrate for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (JOGVUW01) C10 H14 N2 O9 V1 1-,H4 N1 1+,2.5(H2 O1) M.Shimoi,Y.Saito,H.Ogino Bull.Chem.Soc.Jpn., 64, 2629,1991 JOHBUD Cc R=0.0520 mC => mC 0.000 0.00 0.000 100% C2/c trans-1,2-Dinitro(2.2)spiropentane for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (JOHBUD01). C5 H6 N2 O4 P.A.Wade,P.A.Kondracki,P.J.Carroll J.Am.Chem.Soc., 113, 8807,1991 JUXFUD Cc R=0.0560 mC => mC 0.000 0.00 0.000 100% C2/c Ammonio-bis(N-carbazolyl)-bis(1,2-dimethoxyethane)-strontium at 200 deg.K, for re-interpretation in space group C2/c see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (JUXFUD01) C32 H39 N3 O4 Sr1 G.Mosges,F.Hampel,M.Kaupp,P.von Rague Schleyer J.Am.Chem.Soc., 114, 10880,1992 KAJFAC Cc R=0.1160 mC => mC 0.000 0.00 0.000 90% C2/c Cyclotetrakis(3-(((4',6''-heptanediylidene)-m-phenylene)oxy)-2-oxy-quinoxaline) C84 H80 N8 O8,3(C3 H6 O1) E.Dalcanale,P.Soncini,G.Bacchilega,F.Ugozzoli J.Chem.Soc.,Chem.Comm., , 500,1989 KAWDER Aa R=0.0350 mA => mC 0.000 0.00 0.000 96% C2/c Aqua-(ethylenediamine-N,N,N'N'-tetra-acetato-N,N',O,O',O'',O''')-vanadium dihydr ate C10 H17 N2 O8 V1,2(H2 O1) H.Ogino,M.Shimoi,Y.Saito Inorg.Chem., 28, 3596,1989 KAXYOX Cc R=0.0280 mC => mC 0.000 0.00 0.000 100% C2/c bis(Trifluoromethyl)-(N,N-diethyldithiocarbamato-S,S')-copper(iii) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KAXYOX01). C7 H10 Cu1 F6 N1 S2 M.A.Willert-Porada,D.J.Burton,N.C.Baenziger J.Chem.Soc.,Chem.Comm., , 1633,1989 KAYZUF Aa R=0.0350 mA => mC 0.000 0.00 0.000 100% C2/c N,N'-Dimethylpiperazine-2,3-dithione C6 H10 N2 S2 P.C.Servaas,D.J.Stufkens,A.Oskam,P.Vernooijs,E.J.Baerends,D.J.A.De Ridder,C.H.St am Inorg.Chem., 28, 4104,1989 KEGGIM Cc R=0.0300 mC => mC 0.000 0.00 0.000 100% C2/c Cesium 2-(phenylthio)acetate (phenylthio)acetic acid C8 H7 O2 S1 1-,C8 H8 O2 S1,Cs1 1+ T.C.W.Mak,Wai-Hing Yip,Wing-Hong Chan,C.H.L.Kennard,G.Smith,E.J.O'Reilly Polyhedron, 8, 793,1989 KELNOE Cc R=0.0220 mC => mC 0.000 0.00 0.000 96% C2/c Hexa-aqua-(squarato-O)-(squarate-O)-europium monohydrate C8 H13 Eu1 O14,H2 O1 J.-F.Petit,A.Gleizes,J.-C.Trombe Inorg.Chim.Acta, 167, 51,1990 KEPGIV Cc R=0.0600 mC => oF 0.000 0.17 0.048 100% Fdd2 (mu!2$-1,5-bis(2-(2-(2-(2-Methoxyethoxy)ethoxy)ethoxy)ethoxy) anthracene-9,10-di one)-bis(aqua-sodium) di-iodide for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KEPGIV01) C32 H48 Na2 O14 2+,2(I1 1-) Tianbao Lu,Hyunsook Kim Yoo,Hongming Zhang,S.Bott,J.L.Atwood,L.Echegoyen,G.W.Gok el J.Org.Chem., 55, 2269,1990 KEVWUD Ia R=0.0598 mI => hR 0.000 0.01 0.033 100% R3c (Ammonioethyl-bis(amidoethyl)amine-N,N',N'',N''')-silicon (tris(amidoethyl)amine -N,N',N'',N''')-silicon triazide at -20 deg.C, for re-interpretation in space group R3c see R.E.Marsh, Acta Cryst .(B), 53,317,1997 (KEVWUD01) 3(C6 H17 N4 Si1 1+),C6 H16 N4 Si1,3(N3 1-) J.Woning,L.M.Daniels,J.G.Verkade J.Am.Chem.Soc., 112, 4601,1990 KEYKUU Cc R=0.0450 mC => mC 0.000 0.00 0.000 94% C2/c Carbonyl-chloro-p-tolyl-bis(triphenylphosphine)-ruthenium for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KEYKUU01) C44 H37 Cl1 O1 P2 Ru1 C.E.F.Rickard,W.R.Roper,G.E.Taylor,J.M.Waters,L.J.Wright J.Organomet.Chem., 389, 375,1990 KEZGOL Cc R=0.0710 mC => mC 0.000 0.00 0.000 94% C2/c 1,3-bis(4-t-Butyl-2,6-di-isopropylphenyl)-2,2,4,4-tetraisopropylbicyclo(1.1.1)pe ntasilane for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KEZGOL01) C44 H80 Si5 Y.Kabe,T.Kawase,J.Okada,O.Yamashita,M.Goto,S.Masamune Angew.Chem.,Int.Ed.Engl., 29, 794,1990 KEZJOO Cc R=0.0330 mC => mC 0.000 0.00 0.000 100% C2/c catena-(Quinolium bis(mu!2$-iodo)-di-iodo-bismuth(iii)) (C9 H8 N1 1+)n,n(Bi1 I4 1-) S.S.Nagapetyan,A.R.Arakelova,E.A.Ziger,V.M.Koshkin,Yu.T.Struchkov,V.E.Shklover Zh.Neorg.Khim., 34, 2244,1989 KIBZAW Cc R=0.0340 mC => mC 0.000 0.00 0.000 100% C2/c (mu!2$-Oxo)-bis((1,4,7-triazacyclononane-N,N',N'')-dioxo-tungsten) dithionate te trahydrate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KIBZAW01) C12 H30 N6 O5 W2 2+,O6 S2 2-,4(H2 O1) P.Schreiber,K.Wieghardt,B.Nuber,J.Weiss Z.Anorg.Allg.Chem., 587, 174,1990 KIDTIA Cc R=0.0286 mC => mC 0.000 0.00 0.000 100% C2/c tetrakis(mu!3$-Carbonyl)-bis(eta$4!-2,3-dimethyl-1,3-butadiene)-ocatacarbonyl-he xa-rhodium for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KIDTIA01) C24 H20 O12 Rh6 Zhaomin Hou,Y.Wakatsuki,H.Yamazaki J.Organomet.Chem., 399, 103,1990 KIFKIT Cc R=0.0390 mC => mC 0.000 0.00 0.000 100% C2/c (2,8,14,20-Tetramethyl-3,7,15,19,25,26-hexa-azatricyclo(19.3. 1$1,21!.1$9,13!)he xacosa-1(26),2,7,9(25),10,12,14,19,21,23-decaene)-tris(isothiocyanato)-ytt rium for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KIFKIT01). C25 H26 N9 S3 Y1 G.Bombieri,F.Benetollo,A.Polo,L.de Cola,W.T.Hawkins,L.M.Vallarino Polyhedron, 8, 2157,1989 KIFKOZ Cc R=0.0236 mC => mC 0.000 0.00 0.000 100% C2/c (2,7,13,18-Tetramethyl-3,6,14,17,23,24-hexa-azatricyclo(19.3.1.1$8,12!)tetracosa -1(23),2,6,8(24),9,11,13,17,19,21-decaene)-tris(isothiocyanato)-europium(i ii) alpha form, for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst. (B), 53,317,1997 (KIFKOZ02) C25 H26 Eu1 N9 S3 G.Bombieri,F.Benetollo,A.Polo,L.de Cola,W.T.Hawkins,L.M.Vallarino Polyhedron, 8, 2157,1989 KIMSUU Cc R=0.0260 mC => oF 0.000 0.01 0.010 100% Fdd2 Dimethylamino-4'-cyano-1,1'-biphenyl for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KIMSUU01) C15 H14 N2 J.Zyss,I.Ledoux,M.Bertault,E.Toupet Chem.Phys., 150, 125,1991 KIXCAV Cc R=0.0520 mC => mC 0.000 0.00 0.000 100% C2/c (Formato)-bis(triphenylphosphine)-silver for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KIXCAV01). C37 H31 Ag1 O2 P2 Zheng Lan-Sun,Yang Hua-Hui,Zhang Qian-Er Jiegou Huaxue(J.Struct.Chem.), 10, 97,1991 KIXFAY Cc R=0.0290 mC => mC 0.000 0.00 0.000 97% C2/c catena-(bis(mu!2$-Salicylato-O,O')-di-aqua-(salicylato-O,O')-terbium dihydrate) (C21 H19 O11 Tb1)n,2n(H2 O1) Ma Jian-Fang,Jin Zhong-Sheng,Ni Jia-Zuan Jiegou Huaxue(J.Struct.Chem.), 10, 125,1991 KIXFEC Cc R=0.0310 mC => mC 0.000 0.00 0.000 97% C2/c catena-(bis(mu!2$-Salicylato)-di-aqua-salicylato-holmium dihydrate) (C21 H19 Ho1 O11)n,2n(H2 O1) Ma Jian-Fang,Jin Zhong-Sheng,Ni Jia-Zuan Jiegou Huaxue(J.Struct.Chem.), 10, 125,1991 KIYPIR Cc R=0.0270 mC => mC 0.000 0.00 0.000 96% C2/c cis-bis(Tetrahydrothiophene)-bis(4,4'-bis(trifluoromethyl) biphenyl-2,2'-diyl)-p latinum(iv) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KIYPIR01). C36 H28 F12 Pt1 S2 T.Debaerdemaeker,H.Roth,H.-A.Brune J.Organomet.Chem., 412, 243,1991 KIZKIN Cc R=0.0550 mC => oF 0.000 0.09 0.088 100% Fdd2 (mu!2$-Chloro)-(mu!2$-bis(trimethylsilyl)arsine)-bis(bis(eta$5!-cyclopentadienyl )-titanium) at 200 deg.K, for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (KIZKIN01) C26 H38 As1 Cl1 Si2 Ti2 D.Fenske,A.Grissinger,E.M.Hey-Hawkins,J.Magull Z.Anorg.Allg.Chem., 595, 57,1991 KOKBER Cc R=0.0270 mC => mC 0.000 0.00 0.000 100% C2/c 1.3-Propanediammonium bis(dihydrogen monophosphate) C3 H12 N2 2+,2(H2 O4 P1 1-) S.Kamoun,A.Jouini,A.Daoud,A.Durif,J.C.Guitel Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 48, 133,1992 KOLVEM Aa R=0.0910 mA => mC 0.000 0.00 0.000 89% C2/c bis(2-Bromoethyl)-dibromo-selenium C4 H8 Br4 Se1 S.Akabori,Y.Takanohashi,S.Aoki,S.Sato J.Chem.Soc.,Perkin Trans.1, , 3121,1991 KOWDAB Cc R=0.0420 mC => mC 0.000 0.00 0.000 100% C2/c Diaqua-(N,N'-ethylene-bis(N-oxypicolinylideneaminato))-nickel(ii) diperchlorate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (KOWDAB01) C14 H18 N4 Ni1 O4 2+,2(Cl1 O4 1-) Yin Zhanfeng,Wang Guoxiong,Yei Ling,Wang Fengshan,Fan Yuguo Nanjing Univ.Dax.Xuebao,Zir.Kex.(J.N.Uni.(N.S)), 26, 256,1990 KUBRAA Cc R=0.0713 mC => mC 0.000 0.00 0.000 100% C2/c 4,7,13,16-Tetraoxa-1,10-diazatricyclo(8.8.7.1$20,24!)hexacosa-20,22,24(26)-trien e at 341 deg.K, for re-interpretation in space group C2/c see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (KUBRAA01) C20 H32 N2 O4 K.E.Krakowiak,J.S.Bradshaw,N.K.Dalley,Chengyue Zhu,Guoliang Yi,J.C.Curtis,Du Li, R.M.Izatt J.Org.Chem., 57, 3166,1992 KUJMAD Cc R=0.0550 mC => mC 0.000 0.00 0.000 96% C2/c cis-Dichloro-(mu!2$-bis(2,6-diacetylpyridine dioximato)-bis(hydroxophenylborato) )-(mu!2$-methoxo)-di-iron C31 H32 B2 Cl2 Fe2 N6 O7 I.Vasilevsky,N.J.Rose,R.E.Stenkamp Acta Crystallogr.,Sect.B (Str.Sci.), 48, 444,1992 LAJHOT Cc R=0.1200 mC => mC 0.000 0.00 0.000 89% C2/c tris(Tetra-n-butylammonium) hexakis(isothiocyanato)-neodymium 3(C16 H36 N1 1+),C6 N6 Nd1 S6 3- Li Junran,Huang Chunhui,Xu Zhenhua,Xu Guangxian,He Cunheng,Zheng Qitai J.Inorg.Chem.(Wuji Huaxue Xuebao), 8, 49-1,1992 LAYTIO Cc R=0.0363 mC => mC 0.000 0.00 0.000 82% C2/c (eta$6!-Benzene)-(eta$4!-buta-1,3-diene)-ruthenium(0) C10 H12 Ru1 J.Muller,Ke Qiao,M.Siewing,B.Westphal J.Organomet.Chem., 458, 219,1993 LEFWIC Ia R=0.0510 mI => mC 0.000 0.00 0.000 91% C2/c (Hexafluoroacetylacetonato)-bis(trimethylphosphine)-silver at -75 deg.C C11 H19 Ag1 F6 O2 P2 Wenbin Lin,T.H.Warren,R.G.Nuzzo,G.S.Girolami J.Am.Chem.Soc., 115, 11644,1993 LELYEG Cc R=0.0670 mC => mC 0.000 0.00 0.000 100% C2/c catena-(bis(bis(Ethylenedithio)tetrathiafulvalene) bis(mu!2$-thiocyanato-S,N)-ch loro-mercury) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (LELYEG01) (C10 H8 S8)2n,n(C2 Cl1 Hg1 N2 S2) S.V.Konovalikhin,G.V.Shilov,O.A.D'yachenko,R.N.Lyubovskaya,M.Z.Aldoshina,R.B.Lyu bovskii Izv.Akad.Nauk SSSR,Ser.Khim., , 903,1992 LEWZAO Cc R=0.0336 mC => mC 0.000 0.00 0.000 100% C2/c bis(3,4-eta-2,5-Dimethyl-3-hexyne-2,5-diol)-nickel(0) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (LEWZAO01). C16 H28 Ni1 O4 D.Walther,A.Schmidt,T.Klettke,W.Imhof,H.Gorls Angew.Chem.,Int.Ed.Engl., 33, 1373,1994 LEZTAL Ia R=0.0570 mI => mC 0.000 0.00 0.000 100% C2/c (eta$5!-Cyclopentadienyl)-triphenylphosphine-(bis(dimethylsilyl) methoxy-Si,Si') -ruthenium at 150 deg.K, for re-interpretation in space group C2/c see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (LEZTAL01) C28 H35 O1 P1 Ru1 Si2 H.Tobita,H.Wada,K.Ueno,H.Ogino Organometallics, 13, 2545,1994 LISUUR B11b R=0.1200 mB => mC 0.000 0.00 0.000 100% C2/c Urea lithium sulfate 3(C1 H4 N2 O1),2(Li1 1+),O4 S1 2- Kh.Suleimanov,V.S.Sergienko,N.Kipalova,K.Sulaimankulov Koord.Khim., 5, 1732,1979 MAPMIP Cc R=0.0840 mC => mC 0.000 0.00 0.000 100% C2/c 1,5-bis(Dimethylamino)pentamethinium perchlorate space group Cc, yellow form C9 H17 N2 1+,Cl1 O4 1- J.O.Selzer,B.W.Matthews J.Phys.Chem., 80, 631,1976 MERSET Cc R=0.1330 mC => mC 0.000 0.00 0.000 100% C2/c Mercury ethylmercaptide C4 H10 Hg1 S2 D.C.Bradley,N.R.Kunchur Can.J.Chem., 43, 2786,1965 MPBPEU10 B11b R=0.0900 mB => mC 0.000 0.00 0.000 81% C2/c bis(Tri-isobutylphosphonato-O)-tris(4-benzoyl-3-methyl-1-phenyl-5-pyrazolonato-O ,O')-europium C75 H93 Eu1 N6 O14 P2 E.T.Karaseva,V.E.Karasev,A.A.Udovenko,N.I.Sigula Koord.Khim., 9, 692,1983 NABUOX Cc R=0.1090 mC => hR 0.015 0.03 0.218 100% R3c Sodium t-butoxide C4 H9 O1 1-,Na1 1+ T.Greiser,E.Weiss Chem.Ber., 110, 3388,1977 NAMIHP10 Cc R=0.0560 mC => mC 0.000 0.00 0.000 95% C2/c Dodecasodium myo-inositol-hexaphosphate octatriacontahydrate C6 H6 O24 P6 12-,12(Na1 1+),38(H2 O1) G.E.Blank,J.Pletcher,M.Sax Acta Crystallogr.,Sect.B, 31, 2584,1975 NONPIN Cc R=0.1210 mC => mC 0.000 0.00 0.000 100% C2/c Di-n-nonylphosphinic acid for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (NONPIN01) C18 H39 O2 P1 P.Bello Gazz.Chim.Ital., 103, 537,1973 NPHLCU Cc R=0.0800 mC => mC 0.000 0.00 0.000 96% C2/c Nitrato-bis(2,9-dimethyl-1,10-phenanthroline)-copper(ii) trichloroacetate trichl oroacetic acid solvate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (NPHLCU01). C28 H24 Cu1 N5 O3 1+,C2 Cl3 O2 1-,C2 H1 Cl3 O2 M.van Meerssche,G.Germain,J.P.Declercq,L.Wilputte-Steinert Cryst.Struct.Commun., 10, 47,1981 OCYAXM Cc R=0.0780 mC => mC 0.000 0.00 0.000 100% C2/c bis(p-Acetoxyphenyl)cyclo-octylidenemethane for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (OCYAXM01). C25 H28 O4 G.Precigoux,B.Busetta,C.Courseille,M.Hospital,J.F.Miquel Acta Crystallogr.,Sect.B, 34, 3300,1978 OFAFSB10 Cc R=0.0430 mC => mC 0.000 0.00 0.000 100% C2/c bis((mu!2$-Oxo)-(mu!2$-trifluoroacetato-O,O')-trifluoro-antimony(v)) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (OFAFSB01). C4 F12 O5 Sb2 D.P.Bullivant,M.F.A.Dove,M.J.Haley J.Chem.Soc.,Dalton Trans., , 109,1980 OHQMOL02 Cc R=0.0290 mC => mC 0.000 0.00 0.000 100% C2/c bis(8-Hydroxyquinolinato)-dioxo-molybdenum(vi) C18 H12 Mo1 N2 O4 Yu Xiufen Private Communication, , ,1990 OHQMOL12 Cc R=0.0270 mC => mC 0.000 0.00 0.000 100% C2/c bis(8-Hydroxyquinolinato)-dioxo-molybdenum(vi) C18 H14 Mo1 N2 O4 Yu Xiufen,Ji Xinghua Jiegou Huaxue(J.Struct.Chem.), 8, 149,1989 OXIBZN10 Cc R=0.0630 mC => mC 0.000 0.00 0.000 100% C2/c (mu!2$-Oxo)-bis(nitrato-phenyl-iodine(iii)) monoclinic form, at -56 deg.C, for re-interpretation in space group C2/c see R.E .Marsh, Acta Cryst.(B), 53,317,1997 (OXIBZN02) C12 H10 I2 N2 O7 N.W.Alcock,R.M.Countryman J.Chem.Soc.,Dalton Trans., , 851,1979 OXPYRE01 Cc R=0.0870 mC => mC 0.000 0.00 0.000 90% C2/c trans-Dioxo-tetrapyridine-rhenium(v) chloride dihydrate C20 H20 N4 O2 Re1 1+,Cl1 1-,2(H2 O1) C.Calvo,N.Krishnamachari,C.J.L.Lock J.Cryst.Mol.Struct., 1, 161,1971 OXPYRE10 Cc R=0.0420 mC => mC 0.000 0.00 0.000 90% C2/c Dioxo-tetrakis(pyridine)-rhenium(v) chloride dihydrate C20 H20 N4 O2 Re1 1+,Cl1 1-,2(H2 O1) C.J.L.Lock,G.Turner Acta Crystallogr.,Sect.B, 34, 923,1978 OXTCNT Cc R=0.0340 mC => mC 0.000 0.00 0.000 100% C2/c 1,4,11,14,21,24-Hexaoxa-tribenzo(abc,klm,uvw)cyclotriacontane-5, 10,15,20,25,30- hexaone Poly(ethylene terephthalate) cyclic trimer low temperature form. C30 H24 O12 J.Hasek,J.Jecny,V.Langer,K.Huml,P.Sedlacek Acta Crystallogr.,Sect.B, 36, 2698,1980 PEKKOF Cc R=0.0290 mC => mC 0.000 0.00 0.000 100% C2/c bis((eta$5!-Indenyl)-(tetrahydrofuran-O))-ytterbium(ii) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (PEKKOF01) C26 H30 O2 Yb1 Jin Ji-Zhu,Jin Zhong-Sheng,Chen Wen-Qi,Zhang Yin Jiegou Huaxue(J.Struct.Chem.), 12, 241,1993 PENRAB Cc R=0.0590 mC => hR 0.005 0.01 0.031 100% R3c tris(Dimethylamino)-tris(trimethylsilyl)silyl-titanium at 150 deg.K, for re-interpretation in space group R3c see R.E.Marsh, Acta Cryst .(B), 53,317,1997 (PENRAB01) C15 H45 N3 Si4 Ti1 Yu.E.Ovchinnikov,V.A.Igonin,T.V.Timofeeva,S.V.Lindeman,Yu.T.Struchkov,M.V.Ustino v,D.A.Bravo-Zhivotovskii Metalloorg.Khim.(Organometallic Chem.in USSR), 5, 1154,1992 PENREF Cc R=0.0460 mC => hR 0.000 0.01 0.032 100% R3c tris(Dimethylamino)-tris(trimethylsilyl)germyl-titanium at 160 deg.K, for re-interpretation in space group R3c see R.E.Marsh, Acta Cryst .(B), 53,317,1997 (PENREF01). C15 H45 Ge1 N3 Si3 Ti1 Yu.E.Ovchinnikov,V.A.Igonin,T.V.Timofeeva,S.V.Lindeman,Yu.T.Struchkov,M.V.Ustino v,D.A.Bravo-Zhivotovskii Metalloorg.Khim.(Organometallic Chem.in USSR), 5, 1154,1992 PERDIZ Cc R=0.0310 mC => mC 0.000 0.00 0.000 100% C2/c Dichloro-(5,5'-dimethyl-2,2'-bipyridyl-N,N')-platinum(ii) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (PERDIZ01) C12 H12 Cl2 N2 Pt1 V.M.Miskowski,V.H.Houlding,Chi-Ming Che,Yu Wang Inorg.Chem., 32, 2518,1993 PIHXAF Cc R=0.0485 mC => oF 0.000 0.07 0.087 100% Fdd2 ((mu!2$-Sulfido)-(mu!2$-eta$2!,eta$2!-butadiene)-bis(eta$5!-pentamethyl-cyclopen tadienyl))-di-iridium at -20 deg.C, for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (PIHXAF01) C24 H36 Ir2 S1 W.D.Jones,R.M.Chin J.Am.Chem.Soc., 116, 198,1994 PIHXIN Cc R=0.0240 mC => oF 0.000 0.01 0.233 84% Fdd2 (Hydrido-bis(eta$5!-cyclopentadienyl)-(t-butyl-(hydrido-dimethyl)silyl)amido)-zi rconium C16 H27 N1 Si1 Zr1 L.J.Procopio,P.J.Carroll,D.H.Berry J.Am.Chem.Soc., 116, 177,1994 PMPDCU Ic R=0.0510 mI => mC 0.000 0.00 0.000 96% C2/c bis(N-Isopropyl-2-methyl-1,2-propanediamine)-nitro-copper(ii)-nitrite C14 H36 Cu1 N5 O2 1+,N1 O2 1- A.Pajunen,S.Pajunen Acta Crystallogr.,Sect.B, 35, 3058,1979 PYMSTL Cc R=0.1300 mC => mC 0.000 0.00 0.000 100% C2/c Pyromellitic dianhydride-trans-4-methyl-stilbene complex 2(C10 H2 O6),C15 H14 T.Kodama,S.Kumakura Bull.Chem.Soc.Jpn., 47, 2146,1974 QQQAQS01 Cc R=0.0200 mC => mC 0.000 0.00 0.000 100% C2/c Disemicarbazide hydrochloride at -120 deg.C C1 H6 N3 O1 1+,C1 H5 N3 O1,Cl1 1- A.I.Gubin,A.I.Yanovskii,Yu.T.Struchkov,N.N.Nurakhmetov,A.Tashenov,B.A.Beremzhano v,M.Zh.Buranbaev Izv.Akad.Nauk Kaz.SSR,Ser.Khim., , 83-1,1986 RAPREF Cc R=0.0933 mC => mC 0.000 0.00 0.000 94% C2/c bis(mu!2$-t-Butylamido)-bis(2,4,6-trimethylphenyl)-bis(tetrahydrofuran)-lithium- aluminium toluene solvate at 571 deg.K C34 H58 Al1 Li1 N2 O2,C7 H8 D.Rutherford,D.A.Atwood J.Am.Chem.Soc., 118, 11535,1996 RAQYIR Cc R=0.0659 mC => mC 0.000 0.00 0.000 91% C2/c bis((mu!3$-N,N'-bis(o-Hydroxybenzyl)-1,2-diamino-4,5-dimethylbenzene)-bis(isobut yl)-di-aluminium) toluene solvate C60 H76 Al4 N4 O4,C7 H8 D.A.Atwood,M.P.Remington,D.Rutherford Organometallics, 15, 4763,1996 RATRIN Cc R=0.0360 mC => mC 0.000 0.00 0.000 100% C2/c (bis(p-Phenylene)-34-crown-10) hexa-aqua-magnesium diperchlorate C28 H40 O10,H12 Mg1 O6 2+,2(Cl1 O4 1-) D.Marquis,H.Greiving,J.-P.Desvergne,N.Lahrahar,P.Marsau,H.Hopf,H.Bouas-Laurent Liebigs Ann.Chem., , 97,1997 SALBUT Cc R=0.0670 mC => mC 0.000 0.00 0.000 97% C2/c 2-t-Butylamino-1-(4-hydroxy-3-hydroxymethylphenyl)ethanol sulfate Salbutamol drug C13 H22 N1 O3 1+,0.5(O4 S1 2-) J.M.Leger,M.Goursolle,M.Gadret,A.Carpy Acta Crystallogr.,Sect.B, 34, 1203,1978 SAZPEO Ia R=0.0690 mI => mC 0.000 0.00 0.000 91% C2/c bis(2,6-Dimethylpyridine-N)-copper(i) perchlorate monoclinic form, for re-interpretation in space group C2/c see R.E.Marsh, Acta C ryst.(B), 53,317,1997 (SAZPEO01) C14 H18 Cu1 N2 1+,Cl1 O4 1- M.Munakata,S.Kitagawa,H.Shimono Inorg.Chim.Acta, 158, 217,1989 SBFOXS Cc R=0.0390 mC => mC 0.000 0.00 0.000 100% C2/c Sodium bis(trifluoroantimony)oxalate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SBFOXS01) C2 F6 O4 Sb2 2-,2(Na1 1+) P.Escande,D.Tichit,B.Ducourant,R.Fourcade,G.Mascherpa Ann.Chim.(Paris), 3, 117,1978 SEFMEV Cc R=0.0400 mC => hR 0.004 0.01 0.008 100% R3c 3-Amino-4H-1,2,4-benzothiadiazine 1,1-dioxide for corrigendum see Bombieri et al, Acta Cryst.,C46, 1988,1990 C7 H7 N3 O2 S1 G.Bombieri,F.Demartin,D.Braghiroli,S.Todeschi,M.Di Bella Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 45, 1905,1989 SEMJUP Cc R=0.0610 mC => mC 0.000 0.00 0.000 100% C2/c 2,4-Dimethyl-1,5-bis(2,2-dichloro-1-(2',4'-dimethoxyphenyl) ethenyl)benzene for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SEMJUP01). C28 H26 Cl4 O4 S.B.Mahato,N.B.Mandal,A.K.Pal,S.K.Maitra,C.Lehmann,P.Luger J.Org.Chem., 53, 5554,1988 SEYGEI Cc R=0.0368 mC => mC 0.000 0.00 0.000 100% C2/c Dichloro-difluoromethyl-bis(triphenylphosphine)-rhodium(iii) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SEYGEI01). C37 H31 Cl2 F2 P2 Rh1 A.K.Burrell,G.R.Clark,J.G.Jeffery,C.E.F.Rickard,W.R.Roper J.Organomet.Chem., 388, 391,1990 SIKVIR Cc R=0.0460 mC => mC 0.000 0.00 0.000 100% C2/c N-(p-Bromobenzoyl)benzhydrylamine for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SIKVIR01). C20 H16 Br1 N1 O1 M.Crisma,G.Valle,G.M.Bonora,E.De Menego,C.Toniolo,F.Lelj,V.Barone,F.Fraternali Biopolymers, 30, 1,1990 SILJIG Cc R=0.0340 mC => aP 0.000 0.00 0.000 85% P-1 trans-Dichloro-bis(1,3-bis(dimethylarsino)propane-As,As')-rhodium perchlorate C14 H36 As4 Cl2 Rh1 1+,Cl1 O4 1- K.Simonsen,M.Hamada,N.Suzuki,M.Kojima,S.Ohba,F.Galsbol,Y.Saito,J.Fujita Bull.Chem.Soc.Jpn., 63, 2904,1990 SILLUU Cc R=0.0580 mC => mC 0.000 0.00 0.000 100% C2/c (N,N-Dimethyldithiocarbamato-S,S')-bis(bis(dimethylphosphino) methane-P,P')-coba lt(iii) bis(tetrafluoroborate) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SILLUU01). C13 H34 Co1 N1 P4 S2 2+,2(B1 F4 1-) M.Kita,A.Okuyama,K.Kashiwabara,J.Fujita Bull.Chem.Soc.Jpn., 63, 1994,1990 SIRWIZ Cc R=0.0730 mC => oF 0.000 0.02 0.031 100% Fdd2 2,8-Diphenyl-5,6,11,12-tetrahydro-5,11-methanodibenzo(b,f) diazocine for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SIRWIZ01) C27 H22 N2 D.R.Bond,J.L.Scott J.Chem.Soc.,Perkin Trans.2, , 47,1991 SITHAE Ic R=0.0440 mI => mC 0.000 0.00 0.000 100% C2/c mer-Trichloro-tripyridine-titanium(iii) acetonitrile solvate C15 H15 Cl3 N3 Ti1,2(C2 H3 N1) S.I.Troyanov,M.Yu.Furkalyuk,M.A.Simonov Vestn.Mosk.Univ.,Ser.Khim., 30, 281,1989 SIVHIO Cc R=0.0202 mC => mC 0.000 0.00 0.000 100% C2/c cis-Dinitro-bis(ethylenediamine-N,N')-cobalt nitrite for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SIVHIO01) C4 H16 Co1 N6 O4 1+,N1 O2 1- I.Bernal,J.Cetrullo,S.Berhane Struct.Chem., 1, 361,1990 SOGJIH Cc R=0.0710 mC => mC 0.000 0.00 0.000 100% C2/c Diaqua-meso-tetraphenylporphyrinato-tin(iv) bis(trifluoromethanesulfonate) at 163 deg.K C44 H32 N4 O2 Sn1 2+,2(C1 F3 O3 S1 1-) G.Smith,D.P.Arnold,C.H.L.Kennard,T.C.W.Mak Polyhedron, 10, 509,1991 SOMJEJ Cc R=0.0588 mC => mC 0.000 0.00 0.000 100% C2/c (mu!2$-2,2,-Dimethylpropane-1,3-diolato)-bis(phenyl-titanocene) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SOMJEJ01) C37 H40 O2 Ti2 T.T.Nadasdi,D.W.Stephan Can.J.Chem., 69, 167,1991 SOPKEN Cc R=0.0500 mC => mC 0.000 0.00 0.000 88% C2/c Carbonyl-(formato-O,O')-(2-phenylethenyl)-bis(triphenylphosphine)-ruthenium(ii) C46 H38 O3 P2 Ru1 H.Loumrhari,L.Matas,J.Ros,M.R.Torres,A.Perales J.Organomet.Chem., 403, 373,1991 SOTPAS Cc R=0.0361 mC => mC 0.000 0.00 0.000 90% C2/c tetrakis(mu!3$-Carbonyl)-octacarbonyl-tetrakis(dimethylsulfido)-hexa-rhodium n-h exane solvate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (SOTPAS01) C20 H24 O12 Rh6 S4,C6 H14 S.Rossi,K.Kallinen,J.Pursiainen,T.T.Pakkanen,T.A.Pakkanen J.Organomet.Chem., 419, 219,1991 SOXYIN Cc R=0.0460 mC => mC 0.000 0.00 0.000 88% C2/c Triammine-(thiodiacetato-O,O',S)-rhodium(iii) nitrate form I C4 H13 N3 O4 Rh1 S1 1+,N1 O3 1- I.A.Efimenko,E.F.Shubochkina,A.N.Kurbakova,V.E.Mistryukov,Yu.N.Mikhailov,A.S.Kan ishcheva Koord.Khim., 17, 95,1991 SOXYIN01 Cc R=0.0290 mC => mC 0.000 0.00 0.000 82% C2/c Triammine-(thiodiacetato-O,O',S)-rhodium(iii) nitrate form II C4 H13 N3 O4 Rh1 S1 1+,N1 O3 1- I.A.Efimenko,E.F.Shubochkina,A.N.Kurbakova,V.E.Mistryukov,Yu.N.Mikhailov,A.S.Kan ishcheva Koord.Khim., 17, 95,1991 SUJCIJ Cc R=0.0300 mC => mC 0.000 0.00 0.000 96% C2/c trans-Chloro-(o-tolyl)-bis(triethylphosphine)-platinum(ii) C19 H37 Cl1 P2 Pt1 A.L.Rieger,G.B.Carpenter,P.H.Rieger Organometallics, 12, 842,1993 TADXEB Cc R=0.0260 mC => mC 0.000 0.00 0.000 89% C2/c (mu!2$-4-Methyl-2,6-bis(2-(2-pyridyl-N-)ethylimino-N-methyl)-(thiophenolato-S,S) )-bis(chloro-palladium(ii)) chloride methanol solvate monohydrate C23 H23 Cl2 N4 Pd2 S1 1+,Cl1 1-,0.5(C1 H4 O1),H2 O1 B.F.Hoskins,C.J.McKenzie,R.Robson,Lu Zhenrong J.Chem.Soc.,Dalton Trans., , 2637,1990 TADYEC Cc R=0.0514 mC => mC 0.000 0.00 0.000 96% C2/c (mu!2$-1-Diphenylarsino-2-diphenylphosphinoethane)-dichloro-di-gold(i) dimethyla cetamide solvate C26 H24 As1 Au2 Cl2 P1,0.5(C4 H9 N1 O1) O.M.Ni Dhubhghaill,P.J.Sadler,R.Kuroda J.Chem.Soc.,Dalton Trans., , 2913,1990 TAENNI B11b R=0.0820 mB => mC 0.000 0.00 0.000 100% C2/c Tetra-aqua-ethylenediamine-nickel(ii) sulfate dihydrate C2 H16 N2 Ni1 O4 2+,O4 S1 2-,2(H2 O1) A.E.Shvelashvili,R.M.Vashakidze,E.B.Miminoshvili,M.G.Tavberidze,A.I.Kvitashvili, B.M.Shchedrin,E.A.Mikeladze Soob.Akad.Nauk Gruz.SSR, 93, 601,1979 TAJHER Cc R=0.0590 mC => mC 0.000 0.00 0.000 81% C2/c Bicyclohexylammonium hydrogen maleate C12 H24 N1 1+,C4 H3 O4 1- Seik Weng Ng,Wai-Hing Yip,Ru-Ji Wang,T.C.W.Mak Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 47, 398,1991 TARBOD Cc R=0.0940 mC => mC 0.000 0.00 0.000 100% C2/c 1,3,4,5-Neopentanetetrayl tetrakis(3-(3,5-di-t-butyl-4-hydroxyphenyl)propionate) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (TARBOD01) C73 H108 O12 R.Millini,G.Del Piero,M.Bracci Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 48, 696,1992 TAZDED Cc R=0.0280 mC => mC 0.000 0.00 0.000 100% C2/c trans-bis(3,4,5-Trimethylpyrazole)-dichloro-dimethyl-tin(iv) C14 H26 Cl2 N4 Sn1 S.Calogero,G.Valle,P.Cecchi,G.G.Lobbia Polyhedron, 15, 1465,1996 TCYQME02 Cc R=0.0340 mC => mC 0.000 0.00 0.000 100% C2/c 7,7,8,8-Tetracyanoquinodimethane C12 H4 N4 Ma Yingde,Zhang Jintao,Zhnag Zhigui,You Ke,Zhang Hengbin,Guo Chunxiao,Wang Zongm u,Ye Ling,Jin Songchun,Fan Yuguo Jilin Daxue Ziran Kex.Xue., , 99-4,1988 TEFPEZ Cc R=0.0870 mC => mC 0.000 0.00 0.000 92% C2/c tetrakis(4-Methoxyphenyl)porphyrinato-cobalt(ii) benzyl alcohol clathrate C48 H36 Co1 N4 O4,C7 H8 O1 I.Goldberg,H.Krupitsky,Z.Stein,Yu Hsiou,C.E.Strouse Supramolecular Chemistry, 4, 203,1994 TEPSOW Cc R=0.0220 mC => mC 0.000 0.00 0.000 100% C2/c tris(N,N-Dimethyldithiocarbamato)-bis(dimethylsulfoxide)-lanthanum(iii) C13 H30 La1 N3 O2 S8 Chengyong Su,Ning Tang,Minyu Tan,Weisheng Liu,Xinmin Gan,Kaibei Yu J.Coord.Chem., 36, 41,1995 TERZUL Cc R=0.0501 mC => mC 0.000 0.00 0.000 100% C2/c bis(eta$2!-2,5-Dimethylhex-3-yne-2,5-diol)-platinum(0) at 183 deg.K C16 H28 O4 Pt1 D.Walther,T.Klettke,A.Schmidt,H.Gorls,W.Imhof Organometallics, 15, 2314,1996 TEZSOG Cc R=0.0332 mC => mC 0.000 0.00 0.000 98% C2/c bis(rac-exo-mer-Chloro-(2,2-dimethyl-1,3-diaminopropane)-(1,5,9-triazanonane)-ch romium(iii) pentachloro-antimonate(iii)) oxonium chloride monohydrate at 130 deg.K 2(C11 H31 Cl1 Cr1 N5 2+),2(Cl5 Sb1 2-),H3 O1 1+,Cl1 1-,H2 O1 A.Derwahl,W.T.Robinson,D.A.House Inorg.Chim.Acta, 247, 19,1996 THZTAZ Cc R=0.0870 mC => mC 0.000 0.00 0.000 92% C2/c Trihydrazino-triazine C3 H9 N9 D.S.Brown,J.D.Lee,P.R.Russell Acta Crystallogr.,Sect.B, 32, 2101,1976 TIZJIV Cc R=0.0390 mC => mC 0.000 0.00 0.000 80% C2/c catena(bis(mu!2$-Chloro)-(mu!2$-3-triphenylphosphine-propionato-O)-triaqua-(3-tr iphenylphosphine-propionato-O,O')-di-cadmium) (C42 H44 Cd2 Cl3 O7 P2 1+)n,n(Cl1 O4 1-) Song-Lin Li,T.C.W.Mak Polyhedron, 15, 3755,1996 TOMFIK Cc R=0.0317 mC => mC 0.000 0.00 0.000 100% C2/c Dichloro-bis(eta$5!-2-(dimethylamino)indenyl)-zirconium C22 H24 Cl2 N2 Zr1 H.J.G.Luttikhedde,R.P.Leino,C.-E.Wilen,J.H.Nasman,M.J.Ahlgren,T.A.Pakkanen Organometallics, 15, 3092,1996 TOMKUB Cc R=0.0366 mC => oF 0.000 0.07 0.027 100% Fdd2 ((Oxythiobis(4,6-dimethyl-o-phenylene))dioxy)diphenylsilane C28 H26 O3 S1 Si1 A.Chandrasekaran,R.O.Day,R.R.Holmes Organometallics, 15, 3182,1996 TORQUM Cc R=0.0430 mC => mC 0.000 0.00 0.000 100% C2/c Diaqua-bis(acetylsalicylato-O)-zinc C18 H18 O10 Zn1 U.Hartmann,H.Vahrenkamp Bull.Pol.Acad.Sci.,Chem., 42, 155,1994 TOSJOA Cc R=0.0520 mC => oA 0.000 0.25 0.009 100% Ama2 5-Phenyl-tetrazole C7 H6 N4 T.M.Krygowski,M.Cyranski Tetrahedron, 52, 10255,1996 TOYVAE Cc R=0.0510 mC => mC 0.000 0.00 0.000 88% C2/c Tetra-n-propylammonium chloride tris(selenourea) clathrate C12 H28 N1 1+,3(C1 H4 N2 Se1),Cl1 1- Q.Li,T.C.W.Mak Acta Crystallogr.,Sect.B (Str.Sci.), 53, 262,1997 TUCYUL Cc R=0.0291 mC => mC 0.000 0.00 0.000 89% C2/c catena(Dipotassium (mu!2$-oxalato)-bis(oxalato)-zirconium(iv) oxalic acid solvat e monohydrate) (C6 O12 Zr1 2-)n,n(C2 H2 O4),n(H2 O1),2n(K1 1+) R.Baggio,M.T.Garland,M.Perec Inorg.Chem., 36, 737,1997 TUGWOH Cc R=0.0495 mC => mC 0.000 0.00 0.000 89% C2/c 2-Fluorocyclohexanone-3-ol at 150 deg.K C6 H7 F1 O2 R.D.Chambers,J.Hutchinson,A.S.Batsanov,C.W.Lehmann,D.Y.Naumov J.Chem.Soc.,Perkin Trans.1, , 2271,1996 TUHDAB Cc R=0.0680 mC => mC 0.000 0.00 0.000 97% C2/c anti-(+-)-(1-((3,4,1)-6-Methoxybenza)-3,15-bis((4,1,3)-6-methoxybenza)-11,23-bis ((1,3,4)-6-methoxybenza)-13-((4,3,1)-6-methoxybenza)-4,10,16,22,25,31-hexa oxatetracyclo(11.11.7.1$3,23!.1$11,15!)tritriacontaphane) unidentified sol vate C63 H72 O12 C.Garcia,A.Aubry,A.Collet Bull.Soc.Chim.Fr., 133, 853,1996 TUPHER Cc R=0.0510 mC => mC 0.000 0.00 0.000 100% C2/c (eta$5!,eta$5!-1,2-Di-isobutyl-1,2-dimethylethene-1,2-dicyclopentadienyl)-dichlo ro-zirconium C22 H32 Cl2 Zr1 Wang Jia-Xi,Zhang Liu-Cheng,Yang De-Yu,He Zheng-Jie,Chen Shou-Shan Jiegou Huaxue(J.Struct.Chem.), 15, 473,1996 TUQTAA Cc R=0.1093 mC => mC 0.000 0.00 0.000 92% C2/c bis((2,2,2-Cryptand)-potassium) C60-fullerendi-ide toluene solvate at 113 deg.K 2(C18 H36 K1 N2 O6 1+),C60 2-,4(C7 H8) T.F.Fassler,A.Spiekermann,M.E.Spahr,R.Nesper Angew.Chem.,Int.Ed.Engl., 36, 486,1997 VAMYEN Cc R=0.0390 mC => mC 0.000 0.00 0.000 100% C2/c catena-(bis(mu!2$-Chloro)-(2,6-diacetylpyridine dioxime-N,N', N'')-manganese(ii) ) for redetermination see Marsh, Inorg.Chem., 29,572,1990. (C18 H22 Cl4 Mn2 N6 O4)n B.C.Unni Nair,J.E.Sheats,R.Ponteciello,D.Van Engen,V.Petrouleas,G.C.Dismukes Inorg.Chem., 28, 1582,1989 VAWNAI Cc R=0.0480 mC => mC 0.000 0.00 0.000 100% C2/c endo,endo-4,8-Dibromo-2,6-dicyanotricyclo(3.3.3.0$1,5!)undeca-2, 6-diene 4,8-Dibromo-2,6-dicyano(3.3.3)propella-2,6-diene for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (VAWNAI01) C13 H10 Br2 N2 H.Quast,H.Roschert,E.-M.Peters,K.Peters,H.G.von Schnering Liebigs Ann.Chem., , 503,1989 VEJXIR Cc R=0.0560 mC => mC 0.000 0.00 0.000 81% C2/c tetrakis(4-Benzylpyridine-N)-bis(isothiocyanato-N)-nickel(ii) C50 H44 N6 Ni1 S2 L.R.Nassimbeni,M.L.Niven,M.W.Taylor Acta Crystallogr.,Sect.B (Str.Sci.), 46, 354,1990 VEKKAX Cc R=0.0450 mC => mC 0.000 0.00 0.000 89% C2/c (Acetato-O,O')-carbonyl-2-phenylethenyl-bis(triphenylphosphine)-ruthenium C47 H40 O3 P2 Ru1 M.R.Torres,A.Perales,H.Loumrhari,J.Ros J.Organomet.Chem., 385, 379,1990 VETFIJ An R=0.0414 mA => mC 0.000 0.00 0.000 91% C2/c Dichloro-(4',4'''-bis(n-propylthio)-2,2':6',2'':6'',2''':6''', 2''''-quinquepyri dine)-cobalt(ii) methanol solvate at -20 deg.C, for re-interpretation in space group C2/c see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (VETFIJ01). C31 H29 Cl2 Co1 N5 S2,3.12(C1 H4 O1) K.A.Gheysen,K.T.Potts,H.C.Hurrell,H.D.Abruna Inorg.Chem., 29, 1589,1990 VETPUF Aa R=0.0800 mA => mC 0.000 0.00 0.000 80% C2/c (7,11;19,23-Dinitrilo-1,5,13,17-tetra-azacyclotetracosa-1(24),5,7,9,12,17,20,22- octaene)-ethanol-bis(perchlorato-O,O')-barium C22 H28 Ba1 Cl2 N6 O9 C.Harding,D.McDowelll,J.Nelson,S.Raghunathan,C.Stevenson,M.G.B.Drew,P.C.Yates J.Chem.Soc.,Dalton Trans., , 2521,1990 VETZID Cc R=0.0451 mC => mC 0.000 0.00 0.000 88% C2/c cis-bis(Pentafluorophenyl)-(sigma$2!-benzyldimethylamine-C,N)-palladium(ii) C21 H13 F10 N1 Pd1 L.R.Falvello,J.Fornies,R.Navarro,V.Sicilia,M.Tomas Angew.Chem.,Int.Ed.Engl., 29, 891,1990 VETZID10 Cc R=0.0451 mC => mC 0.000 0.00 0.000 88% C2/c cis-bis(Pentafluorophenyl)-(sigma$2!-benzyldimethylamine-C,N)-palladium(ii) C21 H13 F10 N1 Pd1 L.R.Falvello,J.Fornies,R.Navarro,V.Sicilia,M.Tomas J.Chem.Soc.,Dalton Trans., , 3143,1994 VEZLIV Cc R=0.0470 mC => mC 0.000 0.00 0.000 82% C2/c Tetraphenylphosphonium acetato-dichloro-dioxo-ruthenium C2 H3 Cl2 O4 Ru1 1-,C24 H20 P1 1+ W.P.Griffith,J.M.Jolliffe,S.V.Ley,D.J.Williams J.Chem.Soc.,Chem.Comm., , 1219,1990 VICZUC Ia R=0.0540 mI => oF 0.000 0.47 0.065 88% Fdd2 (eta$4!-Tetramethylcyclobutadienyl)-dimethylphenylphosphine-bis(mu!2$-sulfido)-d isulfido-nickel-tungsten for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (VICZUC01). C16 H23 Ni1 P1 S4 W1 K.E.Howard,J.R.Lockemeyer,M.A.Massa,T.B.Rauchfuss,S.R.Wilson,Xiaoguang Yang Inorg.Chem., 29, 4385,1990 VOGHII Cc R=0.0380 mC => mC 0.000 0.00 0.000 100% C2/c (mu!2$-Dimethyl but-2-en-2,3-diyl-1,4-dioate)-bis(carbonyl-chloro-(mu!2$-dipheny l(pyridin-2-yl)phosphine-P,N)-rhodium) 1,2-dichloroethane solvate for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (VOGHII01). C42 H34 Cl2 N2 O6 P2 Rh2,2(C2 H4 Cl2) J.T.Mague Polyhedron, 9, 2635,1990 VOJPEP Cc R=0.0377 mC => mC 0.000 0.00 0.000 100% C2/c Tetrabenzo(b,g,k,p)(1,10,4,6,13,15)dioxatetra-azacyclo-octadeca(2,4,5,7,11,13,14 ,16)octaene C28 H20 N4 O2 A.Stepien,E.Wajsman,M.J.Grabowski,E.Brzezinska,S.Lecocq Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 48, 99,1992 VUFVAT Cc R=0.0730 mC => mC 0.000 0.00 0.000 88% C2/c trans-Diammine-(5,7,12,14-tetramethyl-1,4,8,11-tetra-azacyclotetradecane-N,N',N' ',N''')-chromium(iii) chloride dihydrate C14 H38 Cr1 N6 3+,3(Cl1 1-),2(H2 O1) G.A.Kukina,M.A.Porai-Koshits,V.I.Gerda,Yu.N.Shevchenko,V.N.Shchurkina Kristallografiya, 36, 1301,1991 VUNSAY Cc R=0.0760 mC => mC 0.000 0.00 0.000 89% C2/c pentakis(mu!2$-Isopropoxo)-isopropanol-isopropoxy-(mu!4$-oxo)-tetrakis(chloro-al uminium) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (VUNSAY01) C21 H50 Al4 Cl4 O8 N.Ya.Turova,A.I.Yanovskii,V.G.Kessler,N.I.Kozlova,Yu.T.Struchkov Zh.Neorg.Khim., 36, 2497,1991 WAKMEA Cc R=0.0310 mC => hR 0.000 0.00 0.067 100% R3c tris(Acetato-O)-arsenic for re-interpretation in space group R3c see R.E.Marsh, Acta Cryst.(B), 53,317,1 997 (WAKMEA01) C6 H9 As1 O6 B.Kamenar,M.Bruvo,J.Butumovic Z.Anorg.Allg.Chem., 619, 943,1993 WAZXOK Cc R=0.0620 mC => mC 0.000 0.00 0.000 100% C2/c Diethyl 5,11,17,23-tetra-t-butyl-26,28-bis(2-methoxyethoxy)-calix(4)arene-25,27- bis(oxyacetate) Diethyl (5,11,17,23-tetra-t-butyl-26,28-bis(2-methoxyethoxy) pentacyclo(19.3.1.1 $3,7!.1$9,13!.1$15.19!)octacosa-1(25),3,5,7(28),9,11, 13(27),15,17,19(26), 21,23-dodecaene-25,27-diyldioxy)diacetate C58 H80 O10 A.Guelzim,S.Khrifi,F.Baert,Z.Asfari,J.Vicens Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 49, 2121,1993 WEDNAU Cc R=0.0189 mC => mC 0.000 0.00 0.000 89% C2/c trans-bis(Trimethylphosphite)-carbonyl-dihydrido-nitrosyl-rhenium at 215 deg.K C7 H20 N1 O8 P2 Re1 H.-U.Hund,U.Ruppli,H.Berke Helv.Chim.Acta, 76, 963,1993 WESDUT Cc R=0.0440 mC => oF 0.000 0.18 0.109 100% Fdd2 (Phenyliminomethyl)ferrocenyl for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (WESDUT01). C17 H15 Fe1 N1 R.Bosque,C.Lopez,J.Sales,X.Solans,M.Font-Bardia J.Chem.Soc.,Dalton Trans., , 735,1994 WICHEV Cc R=0.0365 mC => mC 0.000 0.00 0.000 86% C2/c commo-3-Spiro-3'-3,3'-ferrabis(4-dimethylsulfido-1,2-dicarbollide) 2,3-dichloro- 5,6-dicyano-p-benzoquinone radical C8 H32 B18 Fe1 S2 1+,C8 Cl2 N2 O2 1- Yaw-Kai Yan,D.M.P.Mingos,T.E.Muller,D.J.Williams,M.Kurmoo J.Chem.Soc.,Dalton Trans., , 1735,1994 YACGAK Cc R=0.0370 mC => oF 0.000 0.07 0.009 100% Fdd2 2-Dicyanomethylene-1,3-dioxolane for re-interpretation in space group Fdd2 see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (YACGAK01) C6 H4 N2 O2 P.Dastidar,T.N.Guru Row,K.Venkatesan J.Mater.Chem., 1, 1057,1991 YADXUW Ic R=0.0610 mI => mC 0.000 0.00 0.000 100% C2/c cis-6,13-bis(Propylthio)-6,13-dithioxo-5,12-dioxa-6a,7,13a,14-tetra-aza-6,13-dip hosphadibenz(a,h)anthracene for stereoisomer see JAKYOJ C20 H22 N4 O2 P2 S4 Wang Jin-Ling,Zhang Li-Juan,Sun Ming,Miao Fan-Ming,Chen Qi-Jie,Jing Shu-Juan Jiegou Huaxue(J.Struct.Chem.), 11, 222,1992 YAGVIL Cc R=0.0516 mC => mC 0.000 0.00 0.000 93% C2/c 9,11,13,15-Tetrahexyl-7,17:8,16-dimetheno 9H,11H,13H,15H-quinoxalino(2''',3''':2 ''',3''')(1,4)benzodioxonino (10''',9''':5,6)quinoxalino-(2',3':2',3')quin oxalino(2'',3'':2'',3'')(1,4) dioxonino-(6'',5'':9',10')(1,4)benzodioxonin o(6',5':9,10)(1,4) benzodioxonino(2,3-b)quinoxaline difluorobenzene C84 H80 N8 O8,2(C6 H5 F1) P.Soncini,S.Bonsignore,E.Dalcanale,F.Ugozzoli J.Org.Chem., 57, 4608,1992 YAJZUE Cc R=0.0440 mC => mC 0.000 0.00 0.000 90% C2/c (N,N-Dimethyldithiocarbamato-S,S')-bis(1,2-bis(dimethoxyphosphino)ethane)-cobalt bis(tetrafluoroborate) for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (YAJZUE01) C15 H38 Co1 N1 O8 P4 S2 2+,2(B1 F4 1-) M.Kita,M.Okuno,K.Kashiwabara,J.Fujita Bull.Chem.Soc.Jpn., 65, 3042,1992 YAYLIT Cc R=0.0660 mC => mC 0.000 0.00 0.000 81% C2/c Diaqua-2,6-diacetylpyridine-bis(thiosemicarbazone)-zinc dinitrate C11 H19 N7 O2 S2 Zn1 2+,2(N1 O3 1-) A.Bino,N.Cohen Inorg.Chim.Acta, 210, 11,1993 YEGROR Cc R=0.1020 mC => mC 0.000 0.00 0.000 95% C2/c Pusilatin A hexa-acetate C68 H58 O14 T.Hashimoto,T.Yoshida,Y.Kan,S.Takaoka,M.Tori,Y.Asakawa Tetrahedron Lett., 35, 909,1994 YESROD Cc R=0.0710 mC => mC 0.000 0.00 0.000 90% C2/c catena-(bis(bis(Ethylenedithio)tetrathiafulvalene) (mu!2$-thiocyanato-S,N)-dichl oro-mercury) (C10 H8 S8 1+)n,n(C10 H8 S8),n(C1 Cl2 Hg1 N1 S1 1-) S.V.Konovalikhin,G.V.Shilov,O.A.D'yachenko,M.Z.Aldoshina,R.N.Lyubovskaya,R.B.Lyu bovskii Izv.Akad.Nauk SSSR,Ser.Khim., , 2323,1992 YEYNAR Cc R=0.0576 mC => mC 0.000 0.00 0.000 100% C2/c bis(6,7-bis(Methylthio)tetrathiafulvaleno(2,3-b)-1,4-dithiino(5, 6-b)tetrathiafu lvalene) tetracyanoquinodimethane at 153 deg.K, for re-interpretation in space group C2/c see R.E.Marsh, Acta Crys t.(B), 53,317,1997 (YEYNAR01) 2(C14 H8 S12),C12 H4 N4 E.Aqad,J.Y.Becker,J.Bernstein,A.Ellern,V.Khodorkovsky,L.Shapiro J.Chem.Soc.,Chem.Comm., , 2775,1994 YIDYAL Cc R=0.0490 mC => mC 0.000 0.00 0.000 100% C2/c 3,10-Dimethyltricyclo(10.3.0.0$4,9!)pentadeca-3,9-dien-14-one for re-interpretation in space group C2/c see R.E.Marsh, Acta Cryst.(B), 53,317, 1997 (YIDYAL01) C17 H24 O1 T.Takahashi,M.Kotora,K.Kasai,N.Suzuki,K.Nakajima Organometallics, 13, 4183,1994 YIYFIV Cc R=0.0650 mC => mC 0.000 0.00 0.000 100% C2/c bis((mu!2$-bis(Diphenylphosphino)methane)-tricarbonyl-cobalt-gold) C56 H44 Au2 Co2 O6 P4 A.Pons,O.Rossell,M.Seco,A.Perales Organometallics, 14, 555,1995 YOHJOU Cc R=0.0918 mC => mC 0.000 0.00 0.000 100% C2/c catena-(tetrakis(Tetramethylammonium) bis(mu!3$-sulfido)-dodecakis(mu!2$-sulfido )-hexa-tin(iv)) (C4 H12 N1 1+)4n,n(S14 Sn6 4-) Tong Jiang,G.A.Ozin,R.L.Bedard Advanced Materials, 6, 860,1994 YONTOK Cc R=0.0329 mC => mC 0.000 0.00 0.000 100% C2/c (5)Helicene-5,6,9,10-tetracarboxylic-5,6:9,10-dianhydride at 131 deg.K C26 H10 O6 A.A.Frimer,J.D.Kinder,W.J.Youngs,M.A.B.Meador J.Org.Chem., 60, 1658,1995 YOPGIT Cc R=0.0670 mC => mC 0.000 0.00 0.000 100% C2/c trans,cis,cis-bis((Acetonitrile-N)-(diphenylphosphino)acetophenone)-ruthenium(ii ) bis(hexafluorophosphate) C44 H40 N2 O2 P2 Ru1 2+,2(F6 P1 1-) P.Braunstein,Y.Chauvin,J.Nahring,Y.Dusausoy,D.Bayeul,A.Tiripicchio,F.Ugozzoli J.Chem.Soc.,Dalton Trans., , 851,1995 YOVCER Cc R=0.0470 mC => mC 0.000 0.00 0.000 100% C2/c N,N'-bis(2-Aminoethyl)oxamido-bis(1,10-phenanthroline)-nickel(ii) diperchlorate trihydrate C30 H30 N8 Ni2 O2 2+,2(Cl1 O4 1-),3(H2 O1) Ping-Rong Wei,Lu Jia,Chang-Rang Liu,Qiang Han,Ge-Chen Wei,Song Gao Polyhedron, 14, 441,1995 YOYCOE Cc R=0.0782 mC => mC 0.000 0.00 0.000 99% C2/c (mu!2$-eta$3!,eta$2!-1-Thiobutadienyl)-(bis(1,1,1-tris(diphenylphosphinomethyl)e thane-P,P',P''))-di-iridium tetraphenylborate C86 H82 Ir2 P6 S1 2+,2(C24 H20 B1 1-) A.Bacchi,C.Bianchini,V.Herrera,M.V.Jimenez,C.Mealli,A.Meli,S.Moneti,M.Peruzzini, R.A.Sanchez-Delgado,F.Vizza J.Chem.Soc.,Chem.Comm., , 921,1995 YUKFIT Cc R=0.0310 mC => mC 0.000 0.00 0.000 94% C2/c trans-Ammine-hydroxy-bis(1,2-bis(diphenylphosphinoethane))-molybdenum trifluoros ulfonate toluene solvate C52 H51 Mo1 N1 O1 P4 2+,2(C1 F3 O3 S1 1-),C7 H8 T.Adachi,D.L.Hughes,S.K.Ibrahim,S.Okamoto,C.J.Pickett,N.Yabanouchi,T.Yoshida J.Chem.Soc.,Chem.Comm., , 1081,1995 YUKSUS Cc R=0.0360 mC => oF 0.000 0.00 0.034 100% Fdd2 bis(mu!3$-Sulfido)-bis(eta$5!-methoxycarbonyl-cyclopentadienyl)-octacarbonyl-di- iron-di-molybdenum Cc refinement C22 H14 Fe2 Mo2 O12 S2 Li-Cheng Song,Ji-Quan Wang,Qing-Mei Hu Polyhedron, 14, 1101,1995 YURMUT Cc R=0.0380 mC => mC 0.000 0.00 0.000 100% C2/c (N,N'-bis(4-Methoxyphenyl)tetraglycollic diamide-O,O',O'',O''', O'''')-tris(nitr ato-O,O')-neodymium acetonitrile solvate C22 H28 N5 Nd1 O16,2(C2 H3 N1) Zhijian Liang,Xinmin Gan,Ning Tang,Minyu Tan,Kaibei Yu,Ganzu Tan J.Coord.Chem., 30, 103,1993 ZAPHON Cc R=0.0440 mC => oF 0.000 0.03 0.034 100% Fdd2 (mu!2$-Carbonyl)-(mu!2$-3-methylbuta-1,2-dienylidene)-dicarbonyl-bis(eta$5!-pent amethyl-cyclopentadienyl)-di-iron C28 H36 Fe2 O3 M.Terada,Y.Masaki,M.Tanaka,M.Akita,Y.Moro-oka J.Chem.Soc.,Chem.Comm., , 1611,1995 ZAWSUL Cc R=0.0531 mC => mC 0.000 0.00 0.000 100% C2/c (N,N'-Dibenzyl-N,N'-di(quinoline-2-methyl))-1,2-ethylenediamine at 173 deg.K C36 H34 N4 B.Rieger,A.S.Abu-Surrah,R.Fawzi,M.Steiman J.Organomet.Chem., 497, 73,1995 ZAYFIO01 Cc R=0.0270 mC => mC 0.000 0.00 0.000 100% C2/c Tetraethylammonium trans-bis(acetonitrile)-tetrachloro-ruthenium C8 H20 N1 1+,C4 H6 Cl4 N2 Ru1 1- D.Ooyama,N.Nagao,F.S.Howell,M.Mukaida,H.Nagao,K.Tanaka Bull.Chem.Soc.Jpn., 68, 2897,1995 ZDAPSC10 Ia R=0.0580 mI => mC 0.000 0.00 0.000 85% C2/c Aqua-chloro-(2,6-diacetylpyridine-bis(semicarbazone))-zinc chloride dihydrate C11 H17 Cl1 N7 O3 Zn1 1+,Cl1 1-,2(H2 O1) G.J.Palenik,D.W.Wester Inorg.Chem., 17, 864,1978 ZEDCUG Cc R=0.0810 mC => mC 0.000 0.00 0.000 100% C2/c Hexa-t-butyl benzenehexacarboxylate C36 H54 O12 M.Yasuda,G.Kuwamura,T.Nakazono,K.Shima,Y.Inoue,N.Yamasaki,A.Tai Bull.Chem.Soc.Jpn., 67, 505,1994 ZEDTIL Cc R=0.0440 mC => mC 0.000 0.00 0.000 95% C2/c bis(Tetraethylammonium) bis(alpha,2-toluenedithiolato)-oxo-molybdenum(iv) diethy l ether solvate C14 H12 Mo1 O1 S4 2-,2(C8 H20 N1 1+),C4 H10 O1 N.Ueyama,M.Kondo,H.Oku,A.Nakamura Bull.Chem.Soc.Jpn., 67, 1840,1994 ZENREP Cc R=0.0396 mC => mC 0.000 0.00 0.000 93% C2/c 1-((4-Fluorophenyl)methyl)-N-(1-(2-(4-methoxyphenyl)ethyl)-4-piperidyl)-1H-benzi midazol-2-amine Astemizole antihistamine activity C28 H31 F1 N4 O1 O.M.Peeters,N.M.Blaton,C.J.De Ranter Acta Crystallogr.,Sect.C (Cr.Str.Comm.), 51, 2132,1995 ZEPXAT Cc R=0.0380 mC => mC 0.000 0.00 0.000 91% C2/c bis((mu!2$-eta$5!-2,3,4,5-Tetramethyl-cyclopentadienyl)-(eta$5!-cyclopentadienyl )methane)-cobalt-bis((eta$5!-1,2,3,4-tetramethyl-cyclopentadienyl)-iron) t ris(tetracyanoethylene) C48 H62 Co1 Fe2 3+,3(C6 N4 1-) S.Barlow,V.J.Murphy,J.S.O.Evans,D.O'Hare Organometallics, 14, 3461,1995 ZETJIR Cc R=0.0430 mC => mC 0.000 0.00 0.000 88% C2/c 2-(beta-Naphthoxy)-2-thioxo-1,3,2-dithiaphospholane C12 H11 O1 P1 S3 J.Blaszczyk,M.W.Wieczorek,A.Okruszek,M.Olesaik,B.Karwowski Heteroatom Chemistry, 5, 519,1994 ZEZRAX Cc R=0.0460 mC => oF 0.000 0.01 0.013 100% Fdd2 (1-Dimethylamine-2,5-Diphenyl-2,5-dihydro-1H-boroledi-ide) bis(tetramethylethyle ne-lithium) C18 H18 B1 N1 2-,2(C6 H16 Li1 N2 1+) G.E.Herberich,T.Wagner,H.-W.Marx J.Organomet.Chem., 502, 67,1995 ZIRKEQ Cc R=0.0220 mC => mC 0.000 0.00 0.000 100% C2/c bis(Tetrahydroborate-B,H,H')-tetramethylethylenediamine-chromium(ii) at -160 deg.C C6 H24 B2 Cr1 N2 M.Dionne,Shoukang Hao,S.Gambarotta Can.J.Chem., 73, 1126,1995 ZITDOV Cc R=0.0661 mC => oF 0.000 0.18 0.048 100% Fdd2 (mu!2$-eta$6!,eta$6!-1,1'-Diphenylferrocene)-hexacarbonyl-di-chromium C28 H18 Cr2 Fe1 O6 Y.K.Kang,Y.K.Chung,S.W.Lee Organometallics, 14, 4905,1995 ZIZCIU Cc R=0.0710 mC => oF 0.000 0.02 0.194 100% Fdd2 trans-bis(Methylamido)-bis(1-methylcytosine)-platinum(ii) hexafluorophosphate mo nohydrate head-head rotamer. C12 H24 N8 O2 Pt1 2+,2(F6 P1 1-),H2 O1 D.Holthenrich,I.Sovago,G.Fusch,A.Erxleben,E.C.Fusch,I.Rombeck,B.Lippert Z.Naturforsch.,Teil B, 50, 1767,1995 ZIZNOL Cc R=0.0480 mC => mC 0.000 0.00 0.000 93% C2/c bis(Hexafluoroacetylacetonato)-bis(4-phenyl-2,2,5,5-tetramethyl-3-imidazolidine- 3-oxide-1-oxyl)-manganese(ii) C36 H36 F12 Mn1 N4 O8 A.B.Burudukov,N.V.Pervukhina,V.N.Ikorskii,V.I.Ovcharenko Zh.Strukt.Khim., 36, 518,1995 ZIZNUR Cc R=0.0260 mC => mC 0.000 0.00 0.000 92% C2/c tris(Hexafluoroacetylacetonato)-bis(4-phenyl-2,2,5,5-tetramethyl-3-imidazolidine -3-oxide-1-oxyl)-gadolinium(iii) C41 H37 F18 Gd1 N4 O10 A.B.Burudukov,N.V.Pervukhina,V.N.Ikorskii,V.I.Ovcharenko Zh.Strukt.Khim., 36, 518,1995 ZOKDIM Cc R=0.0444 mC => hR 0.049 0.08 0.145 93% R3c (mu!3$-Carbonato)-tris(bis(3-aminopropyl)methylamine)-(perchlorato-O)-copper(ii) perchlorate chirality of structure defined from Flack coefficient C22 H57 Cl3 Cu3 N9 O15 1+,Cl1 O4 1- A.Escuer,R.Vicente,E.Penalba,X.Solans,M.Font-Bardia Inorg.Chem., 35, 248,1996 ZOLZOP Cc R=0.0397 mC => mC 0.000 0.00 0.000 90% C2/c Chloro-bis(2-ethyl-8-quinolato)-nitrosyl-ruthenium(ii) for geometrical isomers see ZOLZEF, ZOLZIJ C22 H20 Cl1 N3 O3 Ru1 H.Ikezawa,Y.Ikezawa,E.Miki,K.Mizumachi,T.Ishimori Inorg.Chim.Acta, 238, 89,1995 ZONWEE Cc R=0.0683 mC => mC 0.000 0.00 0.000 100% C2/c catena-((3,7,15,19-Tetra-oxa-1,9,13,21-tetra-aza-2,5,8,14,17,20(1,2)-hexabenzena -11,23(2,6)-dipyridinacyclotetracosaphane-9,12,21,24(1)-tetraene)-cadmium( ii) bis(mu!3$-thiocyanato)-tetrakis(mu!2$-thiocyanato)-cadmium-di-silver) (C54 H42 Cd1 N6 O4 2+)n,n(C6 Ag2 Cd1 N6 S6 2-) R.W.Matthews,M.McPartlin,I.J.Scowen J.Chem.Soc.,Chem.Comm., , 309,1996