Crystallography Open Database
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Searching journal of publication like 'Chem.Commun.'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2000129 | CIF | C54 H166 F6 Ga32 N12 O148 P32 | I 2 3 | 16.3782; 16.3782; 16.3782 90; 90; 90 | 4393.38 | Reinert, P.; Marler, B.; Patarin, J. Synthesis and characterization of the new microporous fluorogallophosphate Mu-2 with a novel framework topology Chemical Communications, 1998, 1769-1770 |
| 5000033 | CIF | C13 H18 O2 | P 1 21/c 1 | 14.397; 7.818; 10.506 90; 99.7; 90 | 1165.6 | Shankland, Norman; Florence, Alastair J.; Cox, Philip J.; Sheen, David B.; Love, Steve W.; Stewart, Neil S.; Wilson, Chick C. Crystal morphology of ibuprofen predicted from single-crystal pulsed neutron diffraction data Chemical Communications, 1996, 855-856 |
| 5000161 | CIF | C27 H43 N O5 | P 21 21 21 | 16.882; 17.619; 8.497 90; 90; 90 | 2527.38 | Nakano, Kazunori; Sada, Kazuki; Miyata, Mikiji Novel additive effect of inclusion crystals on polymorphs‒cholic acid crystals having different hydrogen-bonded networks with the same organic guest Chemical Communications, 1996, 989-990 |
| 5000287 | CIF | C10 H6 Br4 Cl2 N2 | P b c n | 12.438; 8.753; 13.696 90; 90; 90 | 1491.08 | Gribble, G. W.; Blank, D. H.; Jasinski, J. P. Synthesis and identification of two halogenated bipyrroles present in seabird eggs Chemical Communications, 1999, 2195-2196 |
| 5000295 | CIF | C114 H202 Mn8 O38 | P -1 | 14.7812; 15.0833; 35.2358 78.7348; 84.8151; 61.9138 | 6797.2 | Boskovic, Colette; Huffman, John C.; Christou, George A new synthetic method to Mn carboxylate clusters: reductive fragmentation of [Mn~12~O~12~(O~2~CR)~16~(H~2~O)~4~] to [Mn~8~O~2~(O~2~CR)~14~(RCO~2~H)~4~] (R = CH2But) Chemical Communications, 2002, 2502-2503 |
| 5000311 | CIF | C26 H55 Cl N3 O17 V5 | C 1 2/c 1 | 16.111; 14.9003; 33.674 90; 91.39; 90 | 8081 | Karet, Gail B.; Streib, William E.; Bollinger, John C.; Christou, George; Sun, Ziming; Hendrickson, David N. Stepwise assembly of a polyoxovanadate from mononuclear units in an organic solvent: carboxylate-stabilised fragments in the conversion of [VOCl4]2− to [V15O36]5− Chemical Communications, 2249-2250 |
| 5000373 | CIF | C72 H48 O12 Ti2 | C 1 2/c 1 | 22.924; 17.721; 18.87 90; 129.596; 90 | 5906.7 | Grillo, Vincent A.; Seddon, Elisa J.; Grant, Craig M.; Aromí, Guillem; Bollinger, John C.; Folting, Kirsten; Christou, George Bis(β-diketonate) ligands for the synthesis of bimetallic complexes of Ti^III^, V^III^, Mn^III^ and Fe^III^ with a triple-helix structure Chemical Communications, 1997, 1561-1562 |
| 5000405 | CIF | C42.56 H103.84 N6.28 O36 V15 | C 1 2/c 1 | 22.105; 13.784; 26.604 90; 107.56; 90 | 7728.4 | Karet, Gail B.; Streib, William E.; Bollinger, John C.; Christou, George; Sun, Ziming; Hendrickson, David N. Stepwise assembly of a polyoxovanadate from mononuclear units in an organic solvent: carboxylate-stabilised fragments in the conversion of [VOCl4]2− to [V15O36]5− Chemical Communications, 2249-2250 |
| 7100000 | CIF | C63 H70 N4 O13 | P 1 21/c 1 | 21.48; 15.086; 18.231 90; 109.75; 90 | 5560 | G.W.V.Cave; M.C.Ferrarelli; J.L.Atwood Nano-dimensions for the pyrogallol[4]arene cavity Chemical Communications, 2005 |
| 7100001 | CIF | C13 H16 N4 O2 | P 21 21 2 | 32.0792; 14.408; 7.2035 90; 90; 90 | 3329.44 | Jon Parquette; Judith C. Gallucci; Adam J. Preston The Influence of Sterics on the Formation of Polar 1-D Hydrogen-Bonded Networks Chemical Communications, 2005 |
| 7100002 | CIF | C17 H24 N4 O2 | P 1 21 1 | 6.131; 13.95; 20.22 90; 91.021; 90 | 1729.1 | Chemical Communications, 2005 |
| 7100003 | CIF | C60 H77.5 F4 N6 Na Ni4 O13.25 | I 4 3 2 | 29.5764; 29.5764; 29.5764 90; 90; 90 | 25872 | R. Winpenny; Guillem. Aromi; Aidan Bell; S. J. Teat; Wolfgang Wernsdorfer Synthesis and Characterisation of a {Ni8} Single Molecule Magnet and A Related Cage Chemical Communications, 2005 |
| 7100004 | CIF | C77.3 H115 N56 Na2 Ni8 O29.3 | P 1 21/n 1 | 16.055; 16.408; 23.826 90; 103.176; 90 | 6111 | R. Winpenny; Guillem. Aromi; Aidan Bell; S. J. Teat; Wolfgang Wernsdorfer Synthesis and Characterisation of a {Ni8} Single Molecule Magnet and A Related Cage Chemical Communications, 2005 |
| 7100005 | CIF | C8 H8 Co3 O13 | C 1 2/m 1 | 9.2966; 12.8636; 5.4998 90; 90.533; 90 | 657.68 | Kurmoo, Mohamedally; Kumagai, Hitoshi; Chapman, Karena W.; Kepert, Cameron J. Reversible ferromagnetic-antiferromagnetic transformation upon dehydration-hydration of the nanoporous coordination framework, [Co3(OH)2(C4O4)2] 3H2O Chemical Communications, 2005 |
| 7100006 | CIF | C8 H2 Co3 O10 | C 1 2/m 1 | 9.4684; 12.7225; 5.4873 90; 90.314; 90 | 661 | Chemical Communications, 2005 |
| 7100007 | CIF | C20 H20 O3 S | P n m a | 7.1305; 34.505; 6.8846 90; 90; 90 | 1693.9 | Aitipamula Srinivasulu; Ashwini Nangia Concomitant polymorphs of 2,2',6,6'-tetramethyl-4,4'-terphenyldiol: the b-quinol network reproduced in a metastable polymorph Chemical Communications, 2005 |
| 7100008 | CIF | C22 H22 O2 | R -3 :H | 20.858; 20.858; 10.0116 90; 90; 120 | 3772.1 | Aitipamula Srinivasulu; Ashwini Nangia Concomitant polymorphs of 2,2',6,6'-tetramethyl-4,4'-terphenyldiol: the b-quinol network reproduced in a metastable polymorph Chemical Communications, 2005 |
| 7100009 | CIF | C22 H22 O2 | P 1 21/c 1 | 9.553; 4.5252; 20.21 90; 100.555; 90 | 858.9 | Aitipamula Srinivasulu; Ashwini Nangia Concomitant polymorphs of 2,2',6,6'-tetramethyl-4,4'-terphenyldiol: the b-quinol network reproduced in a metastable polymorph Chemical Communications, 2005 |
| 7100012 | CIF | C37 H36 Cl2 F4 O4 | P -1 | 10.1223; 12.6116; 13.7458 86.93; 89.931; 71.358 | 1660.09 | F. Toda; Shinya Hirano; Masako Kato; Shinji Toyota Isolation of axial conformers of chloro- and bromocyclohexane in a pure state as inclusion complexes with 9,9'-bianthryl, and the discovery of a novel 1,3 axial Cl—H weak hydrogen bond Chemical Communications, 2005 |
| 7100013 | CIF | C34 H29 Cl | P -1 | 12.043; 19.012; 10.994 96.075; 102.296; 89.397 | 2445.3 | Chemical Communications, 2005 |
| 7100016 | CIF | C40 H78 Ni2 O17 | P b c a | 12.088; 19.348; 48.185 90; 90; 90 | 11269 | R. Winpenny; F. P. Booy; Kirsten Christensen; Finn Larsen; Gopalan Rajaraman; G.A.Timco Theoretical studies on bi and tetranuclear Ni pivalate complexes Chemical Communications, 2005 |
| 7100017 | CIF | C78 H77 Cl N2 O2 P2 Ru | P 1 21 1 | 11.735; 17.146; 17.634 90; 105.44; 90 | 3419.9 | Robert H. Morris; Xuanhua Chen.; Christian Elpelt; Rongwei Guo.; Datong Song. A Modular Design of Ruthenium Catalysts with Diamine and Binol-derived Phosphinite Ligands that are Enantiomerically-Matched for the Effective Asymmetric Transfer Hydrogenation of Simple Ketones Chemical Communications, 2005 |
| 7100018 | CIF | C63 H69 F12 N15 O3 P2 Ru | P 21 3 | 18.999; 18.999; 18.999 90; 90; 90 | 6858.1 | Gebhard Haberhauer; Thomas Oeser; Frank Rominger A widely applicable concept for predictable induction of preferred configuration in C3-symmetric systems Chemical Communications, 2005 |
| 7100019 | CIF | C63 H78.6 Ir N12 O10.8 | R 3 :H | 16.2136; 16.2136; 22.0711 90; 90; 120 | 5024.7 | Gebhard Haberhauer; Thomas Oeser; Frank Rominger A widely applicable concept for predictable induction of preferred configuration in C3-symmetric systems Chemical Communications, 2005 |
| 7100020 | CIF | C53 H64 Cl4 N10 O3 | P 1 21 1 | 13.0619; 15.4301; 13.6751 90; 92.057; 90 | 2754.39 | Gebhard Haberhauer; Thomas Oeser; Frank Rominger A widely applicable concept for predictable induction of preferred configuration in C3-symmetric systems Chemical Communications, 2005 |
| 7100021 | CIF | C28 H42 Cu4 N24 O3 W2 | P c c n | 25.6673; 13.4786; 13.5486 90; 90; 90 | 4687.3 | Barbara Sieklucka; Maria Balanda; Tomasz Korzeniak; Kazimierz Kowalski; Robert Pelka; K. Stadnicka; Krzysztof Tomala An unprecedented copper (I,II) octacyanotungstate(V) 2-D network: crystal structure and magnetism of [CuII(tren)]{CuI[WV(CN)8]}*1.5H2O Chemical Communications, 2005 |
| 7100022 | CIF | C84 H56 Cl4 F10 N4 S4 | P 1 21/n 1 | 18.713; 13.74; 29.251 90; 97.38; 90 | 7459 | Tavarekere K. Chandrashekar; B. S. Joshi; Viswanathan PrabhuRaja; Harapriya Rath; Raja Roy; Jeyaraman Sankar Figure-Eight Aromatic Core-modified Octaphyrins With Six meso links: Syntheses and Structural Characterization Chemical Communications, 2005 |
| 7100023 | CIF | C11 H20 Cl N Rh | P 1 2/n 1 | 10.9386; 9.676; 11.3108 90; 99.428; 90 | 1181 | Howard Alper; Jai Jun Kim. Ionic diamine rhodium (I) complexes highly active catalysts for the hydroformylation of olefins Chemical Communications, 2005 |
| 7100024 | CIF | C44 H21 Au3 Cl2 F15 Fe N3 | P 1 21/n 1 | 11.502; 22.9336; 16.601 90; 102.965; 90 | 4267.4 | M.Concepcion Gimeno; Javier E. Aguado; Maria Jose Calhorda; Antonio Laguna Unprecedented 3-M3 Coordination Mode in a Terpyridine Ligand Chemical Communications, 2005 |
| 7100025 | CIF | C27 H40 B6 Fe2 O7 Ru2 | P 1 21/n 1 | 9.6024; 22.536; 16.0264 90; 99.642; 90 | 3419.1 | S.Ghosh; B.C.Noll; T.P.Fehlner Condensed metallaborane clusters: Synthesis and structure of Fe2(CO)6(h5-C5Me5RuCO)(h5-C5Me5Ru)B6H10 Chemical Communications, 2005 |
| 7100026 | CIF | C9 H4 N0.5 Ni S11 | P -1 | 6.454; 7.448; 19.603 99.707; 91.077; 115.569 | 833.5 | Neil Robertson; A.Kuni; Stewart J. Clark; Hengbo Cui.; Wataru Fujita; Hayao Kobayahi; S.S. Staniland; Yoshikatsu Umezono A unique new multiband molecular conductor: [BDTA][Ni(dmit)2]2 Chemical Communications, 2005 |
| 7100029 | CIF | C38 H41 Br2 Cl2 Co I N4 Ni | P 1 21/c 1 | 15.211; 11.6798; 22.888 90; 96.59; 90 | 4039.5 | Hideo Nagashima; Yukihiro Motoyama; Masao Tanabiki; Kazuhiro Tsuchiya Monometallic and Heterobimetallic Azanickellacycles as Ethylene Polymerization Catalysts Chemical Communications, 2005 |
| 7100030 | CIF | C38 H41 Br2 Cl2 I N4 Ni Zn | P 1 21/c 1 | 15.091; 11.585; 22.938 90; 97.1574; 90 | 3979.1 | Chemical Communications, 2005 |
| 7100031 | CIF | C37 H39 I N4 Ni | C 1 2/c 1 | 29.374; 14.767; 17.319 90; 116.599; 90 | 6717.6 | Chemical Communications, 2005 |
| 7100032 | CIF | C11 H15 Na O7 Ru | P -1 | 10.672; 12.45; 14.069 73.26; 75.03; 65.11 | 1603.6 | G. Fachinetti; T. Funaioli; F. Marchetti The Ethene Hydroformylation with CO/H~2~O: Nucleophilic Attack by Water onto a Terminal CO of a Ru(II) Acylcarbonyl Complex Chemical Communications, 2005 |
| 7100033 | CIF | C30 H42 O12 | P 1 21/n 1 | 10.9525; 11.207; 25.0146 90; 97.6555; 90 | 3043.06 | Feihe Huang; Matthew Lam; Eric J. Mahan; Arnold L. Rheingold; Harry W. Gibson Host folding during the formation of a taco complex Chemical Communications, 2005 |
| 7100034 | CIF | C29 H39 O11 | P -1 | 10.3115; 11.0844; 13.8563 76.203; 70.914; 83.447 | 1452.4 | Chemical Communications, 2005 |
| 7100035 | CIF | C47 H67 F12 N2 O13 P2 | P -1 | 11.6764; 15.9293; 16.8706 62.902; 83.88; 73.69 | 2680.1 | Chemical Communications, 2005 |
| 7100036 | CIF | C78 H60 D6 N3 P6 Se6 U | R -3 c :H | 15.1699; 15.1699; 56.846 90; 90; 120 | 11329.1 | A.J. Gaunt; B.L. Scott; M.P. Neu Homoleptic uranium(III) imidodiphoshinochalcogenides including the first structurally characterised molecular trivalent actinide-Se bond Chemical Communications, 2005 |
| 7100037 | CIF | C79 H68 N3 P6 S6 U | R -3 c :H | 15.0066; 15.0066; 56.107 90; 90; 120 | 10942.4 | Chemical Communications, 2005 |
| 7100038 | CIF | C19 H19 N O | P 1 21/c 1 | 10.002; 13.135; 10.948 90; 92.825; 90 | 1436.56 | R.E. Grigg; Laura Cleghorn; Colin Kilner; William S. MacLachlan; V. Sridharan Bimetallic Catalytic Synthesis of Annelated Benzazepines Chemical Communications, 2005 |
| 7100039 | CIF | C26 H25 N | P n a 21 | 10.374; 19.283; 9.733 90; 90; 90 | 1947.01 | R.E.Grigg; Laura Cleghorn; Colin Kilner; William S. MacLachlan; V. Sridharan Bimetallic Catalytic Synthesis of Annelated Benzazepines Chemical Communications, 2005 |
| 7100040 | CIF | C60 H104 Ag4 Cl4 N8 O4 | P 1 | 9.3318; 11.08; 18.816 105.54; 97.78; 94.74 | 1842.6 | Elena Fernandez; Rosa Corberan; Eduardo Peris; Jesus Ramirez; Mercedes Sanau Unprecedented use of silver(I) N-heterocyclic carbene complexes for the catalytic preparation of 1,2-bis(boronate)esters Chemical Communications, 2005 |
| 7100041 | CIF | C38 H27 Au Cl2 N2 | P -1 | 10.052; 10.463; 16.117 82.04; 84.82; 66.02 | 1532.8 | Vivian Yam; Ling-Ling Hung; Hoi-Sing Kwok; Keith Man-Chung Wong; Nianyong Zhu; Xiuling Zhu A novel class of phosphorescent gold(III) alkynyl-based organic light emitting devices with tunable colour Chemical Communications, 2005 |
| 7100044 | CIF | C9 H21 Ag N2 O3.5 | C 1 2/c 1 | 21.5739; 9.8443; 15.7727 90; 125.341; 90 | 2732.5 | Dario Braga; Marco Curzi; F. Grepioni; Marco Polito Mechanochemical and Solution Reactions Between AgCH3COO and [H2NC6H10NH2] Yield Three Isomers of the Coordination Network {Ag[H2NC6H10NH2]+} Chemical Communications, 2005 |
| 7100045 | CIF | C8 H25 Ag N2 O6 | P -1 | 8.7808; 12.81; 13.706 95.35; 90.898; 108.9 | 1450.5 | Dario Braga; Marco Curzi; F. Grepioni; Marco Polito Mechanochemical and Solution Reactions Between AgCH3COO and [H2NC6H10NH2] Yield Three Isomers of the Coordination Network {Ag[H2NC6H10NH2]+} Chemical Communications, 2005 |
| 7100046 | CIF | C8 H23 Ag N2 O5 | P -1 | 6.108; 10.18; 11.849 105.91; 97.78; 99.37 | 686.4 | Dario Braga; Marco Curzi; F. Grepioni; Marco Polito Mechanochemical and Solution Reactions Between AgCH3COO and [H2NC6H10NH2] Yield Three Isomers of the Coordination Network {Ag[H2NC6H10NH2]+} Chemical Communications, 2005 |
| 7100047 | CIF | C56 H58 N4 O16 V | C 1 2/m 1 | 16.297; 27.009; 8.878 90; 115.11; 90 | 3538.5 | Chi Ming Che.; Nancy P. Y. Chung; Chen-Lung Li.; Raymond Sun.; Suk-Yu Wong. Physiologically Stable Vanadium(IV) Porphyrins as a New Class of Anti-HIV Agents Chemical Communications, 2005 |
| 7100048 | CIF | C8 H25 Ga2 N3 | P 21 21 21 | 6.1939; 12.977; 17.601 90; 90; 90 | 1414.8 | Wayne Gladfelter; Benjamin E. Kuccera; Bing Luo Mono- and digallane complexes of a tridentate amido-diamine ligand Chemical Communications, 2005 |
| 7100049 | CIF | C8 H22 Ga N3 | P b c n | 11.01; 11.706; 9.4523 90; 90; 90 | 1218.2 | Wayne Gladfelter; Benjamin E. Kuccera; Bing Luo Mono- and digallane complexes of a tridentate amido-diamine ligand Chemical Communications, 2005 |
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