Crystallography Open Database
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Result : There are 111 entries in the selection
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Searching space group like 'I 2 2 2'
| COD ID: 1509698 | |
| CIF file | Formula: - Ag2 Ba Ge Se4 - Comments: Johrendt, D.; Tampier, M. Neue azentrische Selenogermanate. I. Kristallstrukturen und chemische Bindung von A M2 Ge Se4 (A=Sr, Ba; M=Cu, Ag) Zeitschrift fuer Anorganische und Allgemeine Chemie 627 (2001) 312-320 Space group: I 2 2 2 Cell volume: 423.067 Cell parameters: 7.058; 7.263; 8.253; 90; 90; 90; |
| COD ID: 1509717 | |
| CIF file | Formula: - Ag2 Ba S4 Sn - Comments: Teske, C.L.; Vetter, O. Ergebnisse einer Roentgenstrukturanalyse von SilberBarium-Thiostannat(IV), Ag2 Ba Sn S4 Zeitschrift fuer Anorganische und Allgemeine Chemie 427 (1976) 200-204 Space group: I 2 2 2 Cell volume: 396.503 Cell parameters: 7.127; 8.117; 6.854; 90; 90; 90; |
| COD ID: 1518706 | |
| CIF file | Formula: - Al10 Cl2 H16 K12 O48 Si10 - Comments: Norlund Christensen, A.; Fjellvag, H. Neutron powder diffraction study of the dehydration of zeolite N Acta Chemica Scandinavica 53 (1999) 85-89 Space group: I 2 2 2 Cell volume: 1274.8 Cell parameters: 9.88; 9.877; 13.064; 90; 90; 90; |
| COD ID: 1518707 | |
| CIF file | Formula: - Al10 Cl2 H16 K12 O48 Si10 - Comments: Norlund Christensen, A.; Fjellvag, H. Neutron powder diffraction study of the dehydration of zeolite N Acta Chemica Scandinavica 53 (1999) 85-89 Space group: I 2 2 2 Cell volume: 1252.1 Cell parameters: 9.779; 9.743; 13.142; 90; 90; 90; |
| COD ID: 1527025 | |
| CIF file | Formula: - Al4 H36 Mg1.6 Na2.6 O90 Si32 - Comments: Yokomori, Y.; Nishi, K.; Wachsmuth, J. Structure and Bronsted acid sites of ferrierite Microporous and Mesoporous Materials 50 (2001) 137-143 Space group: I 2 2 2 Cell volume: 2030.77 Cell parameters: 19.186; 14.143; 7.484; 90; 90; 90; |
| COD ID: 1529235 | |
| CIF file | Formula: - Nd2 O6 S - Comments: Golovnev, Nikolay; Molokeev, Maxim; Vereshchagin, Sergey; Atuchin, Victor Synthesis and thermal transformation of a neodymium(III) complex [Nd(HTBA)2(C2H3O2)(H2O)2].2H2O to noncentrosymmetric oxosulfate Nd2O2SO4 Journal of Coordination Chemistry 68(11) (2015) 1865 Space group: I 2 2 2 Cell volume: 232.27 Cell parameters: 4.11991; 4.22332; 13.349; 90; 90; 90; |
| COD ID: 1535404 | |
| CIF file | Formula: - Fe Na S2 - Comments: Boller, H.; Blaha, H. Zur Kenntnis des Natriumthioferrates(III) Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-) 114 (1983) 145-154 Space group: I 2 2 2 Cell volume: 365.513 Cell parameters: 6.25; 10.83; 5.4; 90; 90; 90; |
| COD ID: 1543353 | |
| CIF file | Formula: - C120 H204 N84 O47.5 Pd12 - Comments: Howlader, Prodip; Mukherjee, Partha Sarathi Face and edge directed self-assembly of Pd12tetrahedral nano-cages and their self-sorting Chem. Sci. 7(9) (2016) 5893 Space group: I 2 2 2 Cell volume: 10065.9 Cell parameters: 19.9984; 22.3102; 22.5607; 90; 90; 90; |
| COD ID: 1550533 | |
| CIF file | Formula: - C36 H72 Mn4 O16 - Comments: Nagae, Haruki; Hirai, Takahiro; Kato, Daiki; Soma, Shusei; Akebi, Shin-ya; Mashima, Kazushi Dinuclear Manganese Alkoxide Complexes as Catalysts for C—N Bond Cleavage of Simple Tertiary N,N-Dialkylamides to Give Esters Chemical Science (2019) Space group: I 2 2 2 Cell volume: 2426.2 Cell parameters: 12.1248; 14.1447; 14.1468; 90; 90; 90; |
| COD ID: 1553106 | |
| CIF file | Formula: - C33 H30 Br N O5 - Comments: Zhang, Jun-Wei; Liu, Xiao-Wei; Gu, Qing; Shi, Xiao-Xin; You, Shu-Li Enantioselective synthesis of 4,5,6,7-tetrahydroindoles via olefin cross-metathesis/intramolecular Friedel‒Crafts alkylation reaction of pyrroles Organic Chemistry Frontiers 2(5) (2015) 476 Space group: I 2 2 2 Cell volume: 12578 Cell parameters: 15.713; 28.08; 28.507; 90; 90; 90; |
| COD ID: 1562833 | |
| CIF file | Formula: - C19 H9.5 B Li N0.5 O6 - Comments: Hu, Yiming; Teat, Simon J.; Gong, Wei; Zhou, Zhou; Jin, Yinghua; Chen, Hongxuan; Wu, Jingyi; Cui, Yong; Jiang, Tao; Cheng, Xinbin; Zhang, Wei Single crystals of mechanically entwined helical covalent polymers Nature Chemistry (2021) 1 Space group: I 2 2 2 Cell volume: 5738.5 Cell parameters: 15.2478; 19.3901; 19.4093; 90; 90; 90; |
| COD ID: 1562834 | |
| CIF file | Formula: - C19 H10 B Li N0.5 O6.25 - Comments: Hu, Yiming; Teat, Simon J.; Gong, Wei; Zhou, Zhou; Jin, Yinghua; Chen, Hongxuan; Wu, Jingyi; Cui, Yong; Jiang, Tao; Cheng, Xinbin; Zhang, Wei Single crystals of mechanically entwined helical covalent polymers Nature Chemistry (2021) 1 Space group: I 2 2 2 Cell volume: 5744.8 Cell parameters: 15.2523; 19.3821; 19.4331; 90; 90; 90; |
| COD ID: 2007213 | |
| CIF file | Formula: - C20 H35 O7.5 - Comments: Drouin, Marc; Dodier, Marco; Ruest, Luc 3D/2D Hydrogen-Bond Network Preferences for Five New Ryanoid Derivatives Acta Crystallographica Section C 54(5) (1998) 687-693 Space group: I 2 2 2 Cell volume: 4101.5 Cell parameters: 8.914; 18.1678; 25.326; 90; 90; 90; |
| COD ID: 2015017 | |
| CIF file | Formula: - C20 H39 Cl2 N2 O0.5 Pd - Comments: Vázquez, Jaime; Bernès, Sylvain; Meléndez, Ruth; Portillo, Roberto; Gutiérrez, René Conformational change induced by hydration: <i>trans</i>-dichlorobis[(1<i>R</i>,2<i>R</i>,3<i>R</i>,5<i>S</i>)-(‒)-isopinocampheylamine]palladium(II) and <i>trans</i>-dichlorobis[(1<i>S</i>,2<i>S</i>,3<i>S</i>,5<i>R</i>)-(+)-isopinocampheylamine]palladium(II) hemihydrate Acta Crystallographica Section C 61(9) (2005) m424-m427 Space group: I 2 2 2 Cell volume: 2528.4 Cell parameters: 6.6873; 13.427; 28.159; 90; 90; 90; |
| COD ID: 2021888 | |
| CIF file | Formula: - F4 H12 N3 O2 V - Comments: Udovenko, Anatoly A.; Pogoreltsev, Evgeny I.; Marchenko, Yuri V.; Laptash, Natalia M. Orientational disorder and phase transitions in ammonium oxofluorovanadates, (NH4)3VOF5 and (NH4)3VO2F4 Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials 73(6) (2017) 1085 Space group: I 2 2 2 Cell volume: 1080.33 Cell parameters: 6.2738; 9.1388; 18.8424; 90; 90; 90; |
| COD ID: 2101613 | |
| CIF file | Formula: - C41 H46 Cl2 I N4 Na O4 - Comments: Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Alihodžić, Sulejman; Trinajstić, Nenad Bond length‒bond order relations and calculated geometries for some benzenoid aromatics, including phenanthridine. Structures of 5,6-dimethylphenanthridinium triflate, [<i>N</i>-(6-phenanthridinylmethyl)-aza-18-crown-6-κ^5^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''',<i>O</i>''''](picrate-κ^2^-<i>O</i>,<i>O</i>')potassium, and [<i>N</i>,<i>N</i>'-bis(6-phenanthridinyl-κ<i>N</i>-methyl)-7,16-diaza-18-crown-6-κ^4^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''']sodium iodide dichloromethane solvate Acta Crystallographica Section B 52(5) (1996) 823-837 Space group: I 2 2 2 Cell volume: 4000.7 Cell parameters: 10.453; 13.417; 28.526; 90; 90; 90; |
| COD ID: 2219877 | |
| CIF file | Formula: - C6 H11 K N4 O5 - Comments: Karapetyan, Harutyun A. Potassium <small>L</small>-2-nitrimino-1,3-diazepane-4-carboxylate monohydrate Acta Crystallographica Section E 64(11) (2008) m1369 Space group: I 2 2 2 Cell volume: 2163.6 Cell parameters: 7.3883; 10.087; 29.031; 90; 90; 90; |
| COD ID: 4000014 | |
| CIF file | Formula: - C24 H16 N4 Rb S12 Se8 Zn - Comments: Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts Chemistry of Materials 12(10) (2000) 2984-2987 Space group: I 2 2 2 Cell volume: 2100 Cell parameters: 10.137; 44.006; 4.709; 90; 90; 90; |
| COD ID: 4000015 | |
| CIF file | Formula: - C24 H16 Co Cs N4 S12 Se8 - Comments: Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts Chemistry of Materials 12(10) (2000) 2984-2987 Space group: I 2 2 2 Cell volume: 2123 Cell parameters: 9.812; 44.104; 4.907; 90; 90; 90; |
| COD ID: 4000016 | |
| CIF file | Formula: - C24 H16 Cs N4 S12 Se8 Zn - Comments: Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts Chemistry of Materials 12(10) (2000) 2984-2987 Space group: I 2 2 2 Cell volume: 2125 Cell parameters: 9.818; 44.13; 4.906; 90; 90; 90; |
| COD ID: 4000018 | |
| CIF file | Formula: - C24 H16 Co N4 Rb S12 Se8 - Comments: Mori, Hatsumi; Sakurai, Naoki; Tanaka, Shoji; Moriyama, Hiroshi; Mori, Takehiko; Kobayashi, Hayao; Kobayashi, Akiko Control of Electronic State by Dihedral Angle in θ-type Bis(ethylenedithio)tetraselenafulvalene Salts Chemistry of Materials 12(10) (2000) 2984-2987 Space group: I 2 2 2 Cell volume: 2098 Cell parameters: 10.128; 43.97; 4.71; 90; 90; 90; |
| COD ID: 4000566 | |
| CIF file | Formula: - Ag2 Ba Se4 Sn - Comments: Chemistry of Materials (2005) Space group: I 2 2 2 Cell volume: 444.9 Cell parameters: 7.1154; 7.4994; 8.3375; 90; 90; 90; |
| COD ID: 4020553 | |
| CIF file | Formula: - C9 H12 N2 O4 - Comments: Stefan Spange; Katja Hofmann; Bernhard Walfort; Tobias Rüffer; Heinrich Lang Chiral 1,2- and 1,3-Diol-Functionalized Chromophores as Lego Building Blocks for Coupled Structures Journal of Organic Chemistry 70 (2005) 8564-8567 Space group: I 2 2 2 Cell volume: 1978.2 Cell parameters: 6.8961; 14.1021; 20.3417; 90; 90; 90; |
| COD ID: 4030289 | |
| CIF file | Formula: - C27 H44.5 O3 - Comments: Sokolowska, Katarzyna; Carballa, Diego; Seoane, Samuel; Pérez-Fernández, Román; Mouriño, Antonio; Sicinski, Rafal R. Synthesis and Biological Activity of Two C-7 Methyl Analogues of Vitamin D. The Journal of organic chemistry 80(1) (2014) 165 Space group: I 2 2 2 Cell volume: 7156 Cell parameters: 7.2241; 30.833; 32.125; 90; 90; 90; |
| COD ID: 4064245 | |
| CIF file | Formula: - C52 H92 O4 Y4 - Comments: Shima, Takanori; Nishiura, Masayoshi; Hou, Zhaomin Tetra-, Penta-, and Hexanuclear Yttrium Hydride Clusters from Half-Sandwich Bis(aminobenzyl) Complexes Containing Various Cyclopentadienyl Ligands Organometallics 30(9) (2011) 2513 Space group: I 2 2 2 Cell volume: 3200.8 Cell parameters: 12.371; 15.336; 16.871; 90; 90; 90; |
| COD ID: 4081833 | |
| CIF file | Formula: - C40 H60 O Ti2 - Comments: Pinkas, Jiří; Císařová, Ivana; Gyepes, Róbert; Kubišta, Jiří; Horáček, Michal; Mach, Karel Synthesis and Structure of Titanium(III) Bis(decamethyltitanocene) Oxide Organometallics 32(21) (2013) 6306 Space group: I 2 2 2 Cell volume: 1745.53 Cell parameters: 11.1196; 11.262; 13.9387; 90; 90; 90; |
| COD ID: 4100542 | |
| CIF file | Formula: - C6 H20 Br3 N4 Ni - Comments: Mari Sasaki; Shinya Takaishi; Hitoshi Miyasaka; Ken-ichi Sugiura; Masahiro Yamashita Novel Quasi-One-Dimensional Halogen-Bridged PtII-PtIV Mixed-Valence Compounds with Magnetic Counter-anions, {[Pt(en)2][PtX2(en)2]}3{(MX5)X3}2 12H2O (M=Co2+, Mn2+, and Fe2+; X=Cl- and Br-) Journal of the American Chemical Society (2005) Space group: I 2 2 2 Cell volume: 691.1 Cell parameters: 19.35; 5.11; 6.988; 90; 90; 90; |
| COD ID: 4101476 | |
| CIF file | Formula: - C12 H28 I3 N4 Pt - Comments: Takaishi, Shinya; Kawakami, Daisuke; Yamashita, Masahiro; Sasaki, Mari; Kajiwara, Takashi; Miyasaka, Hitoshi; Sugiura, Ken-Ichi; Wakabayashi, Yusuke; Sawa, Hiroshi; Matsuzaki, Hiroyuki; Kishida, Hideo; Okamoto, Hiroshi; Watanabe, Harutaka; Tanaka, Hisaaki; Marumoto, Kazuhiro; Ito, Hiroshi; Kuroda, Shin-Ichi Dynamical valence fluctuation at the charge-density-wave phase boundary in iodide-bridged Pt compound [Pt(chxn)2I]I2. Journal of the American Chemical Society 128(19) (2006) 6420-6425 Space group: I 2 2 2 Cell volume: 969 Cell parameters: 23.443; 5.6718; 7.288; 90; 90; 90; |
| COD ID: 4108884 | |
| CIF file | Formula: - C20 H20 N2 O9 - Comments: Xiaobo Wan; Madeleine M. Joullié Enantioselective Total Syntheses of Trichodermamides A and B Journal of the American Chemical Society 130 (2008) 17236-17237 Space group: I 2 2 2 Cell volume: 4803.7 Cell parameters: 10.9542; 13.6868; 32.04; 90; 90; 90; |
| COD ID: 4111910 | |
| CIF file | Formula: - C64 H56 F42 I N32 Ni4 Sb7 - Comments: Cristian Saul Campos-Fernández; Brandi L. Schottel; Helen T. Chifotides; Jitendra K. Bera; John Bacsa; John M. Koomen; David H. Russell; Kim R. Dunbar Anion Template Effect on the Self-Assembly and Interconversion of Metallacyclophanes Journal of the American Chemical Society 127 (2005) 12909-12923 Space group: I 2 2 2 Cell volume: 6101 Cell parameters: 18.145; 14.925; 22.529; 90; 90; 90; |
| COD ID: 4111911 | |
| CIF file | Formula: - C64 H56 B F46 N32 Ni4 P Sb6 - Comments: Cristian Saul Campos-Fernández; Brandi L. Schottel; Helen T. Chifotides; Jitendra K. Bera; John Bacsa; John M. Koomen; David H. Russell; Kim R. Dunbar Anion Template Effect on the Self-Assembly and Interconversion of Metallacyclophanes Journal of the American Chemical Society 127 (2005) 12909-12923 Space group: I 2 2 2 Cell volume: 5889 Cell parameters: 17.869; 14.762; 22.326; 90; 90; 90; |
| COD ID: 4115855 | |
| CIF file | Formula: - C6 H18 F4 Ge14 N3 O32 - Comments: Jacques Plévert; Travis M. Gentz; Aaron Laine; Hailian Li; Victor G. Young; Omar M. Yaghi; Michael O'Keeffe A Flexible Germanate Structure Containing 24-Ring Channels and with Very Low Framework Density Journal of the American Chemical Society 123 (2001) 12706-12707 Space group: I 2 2 2 Cell volume: 12397.5 Cell parameters: 16.9109; 24.267; 30.21; 90; 90; 90; |
| COD ID: 4116908 | |
| CIF file | Formula: - C48 H108 I8 Mo4 P4 - Comments: F. Albert Cotton; Lee M. Daniels; Isabelle Guimet; Robert W. Henning; Glenn T. Jordan; Chun Lin; Carlos A. Murillo; Arthur J. Schultz Compounds with Two Metal-Metal Multiple Bonds: New Ways of Making Doublets into Cyclic Quartets Journal of the American Chemical Society 120 (1998) 12531-12538 Space group: I 2 2 2 Cell volume: 3745.6 Cell parameters: 12.19; 15.673; 19.605; 90; 90; 90; |
| COD ID: 4123929 | |
| CIF file | Formula: - Cs14 D12.32 Li41.12 O178.16 Si72 - Comments: Park, S.-H.; Grey, C.P.; Parise, J.B.; Gies, H.; Liu, H.-M.; Toby, B.H. A new porous lithosilicate with a high ionic conductivity and ion-exchange capacity Journal of the American Chemical Society 122 (2000) 11023-11024 Space group: I 2 2 2 Cell volume: 4559.9 Cell parameters: 11.208; 17.286; 23.536; 90; 90; 90; |
| COD ID: 4124200 | |
| CIF file | Formula: - C10 H8 F3 Fe N2 - Comments: Lu, Hongcheng; Yamamoto, Takafumi; Yoshimune, Wataru; Hayashi, Naoaki; Kobayashi, Yoji; Ajiro, Yoshitami; Kageyama, Hiroshi A Nearly Ideal One-Dimensional S = 5/2 Antiferromagnet FeF3(4,4'-bpy) (4,4'-bpy =4,4'-bipyridyl) with Strong Intrachain Interactions. Journal of the American Chemical Society 137(31) (2015) 9804-9807 Space group: I 2 2 2 Cell volume: 478.72 Cell parameters: 3.89; 10.7997; 11.3951; 90; 90; 90; |
| COD ID: 4132954 | |
| CIF file | Formula: - C24 H16 Cl4 Cu5 N4 O9 - Comments: Jiang, Jingjing; Lu, Zhiyong; Zhang, Mingxing; Duan, Jingui; Zhang, Wenwei; Pan, Yi; Bai, Junfeng Higher Symmetry Multinuclear Clusters of Metal-Organic Frameworks for Highly Selective CO<sub>2</sub> Capture. Journal of the American Chemical Society 140(51) (2018) 17825-17829 Space group: I 2 2 2 Cell volume: 2106.3 Cell parameters: 11.684; 12.866; 14.0116; 90; 90; 90; |
| COD ID: 4303065 | |
| CIF file | Formula: - C16 H44 N2 O22 V2 - Comments: Jana Gáliková; Peter Schwendt; Jozef Tatiersky; Alan S. Tracey; Zdirad Žák Stereospecific Formation of Dinuclear Vanadium(V) Tartrato Complexes Inorganic Chemistry 48 (2009) 8423-8430 Space group: I 2 2 2 Cell volume: 1513 Cell parameters: 8.0275; 8.3123; 22.674; 90; 90; 90; |
| COD ID: 4307562 | |
| CIF file | Formula: - C10 H8 F3 N2 V - Comments: David W. Aldous; Nicholas F. Stephens; Philip Lightfoot Hydrothermal Vanadium Fluoride Chemistry: Four New V3+ Chain Structures Inorganic Chemistry 46 (2007) 3996-4001 Space group: I 2 2 2 Cell volume: 462.5 Cell parameters: 3.797; 10.769; 11.312; 90; 90; 90; |
| COD ID: 4310557 | |
| CIF file | Formula: - C52 H40 Cl18 Mn4 N8 O10 - Comments: Nizamuddin Shaikh; Anangamohan Panja; Sanchita Goswami; Pradyot Banerjee; Pavel Vojtíšek; Yuan-Zhu Zhang; Gang Su; Song Gao Slow Magnetic Relaxation in a Mixed-Valence Mn(II/III) Complex: [MnII2(bispicen)2(μ3-Cl)2MnIII(Cl4Cat)2MnIII(Cl4Cat)2(H2O)2]∞ Inorganic Chemistry 43 (2004) 849-851 Space group: I 2 2 2 Cell volume: 3374.2 Cell parameters: 9.348; 12.654; 28.525; 90; 90; 90; |
| COD ID: 4320687 | |
| CIF file | Formula: - C12 H28 Br3 Cu0.5 N4 Pt0.5 - Comments: Takuya Kawashima; Kenzi Takai; Hidemitsu Aso; Toshio Manabe; Kouichi Takizawa; Chihiro Kachi-Terajima; Tomohiko Ishii; Hitoshi Miyasaka; Hiroyuki Matsuzaka; Masahiro Yamashita; Hiroshi Okamoto; Hiroshi Kitagawa; Motoo Shiro; Koshiro Toriumi Syntheses and Physical Properties of Quasi-One-Dimensional Halogen-Bridged CuII-PtIV Mixed-Metal Complexes [Cu(chxn)2][PtX2(chxn)2]X4 Inorganic Chemistry 40 (2001) 6651-6655 Space group: I 2 2 2 Cell volume: 883.8 Cell parameters: 6.978; 23.7; 5.344; 90; 90; 90; |
| COD ID: 4320688 | |
| CIF file | Formula: - C24 H56 Cl6 Cu N8 Pt - Comments: Takuya Kawashima; Kenzi Takai; Hidemitsu Aso; Toshio Manabe; Kouichi Takizawa; Chihiro Kachi-Terajima; Tomohiko Ishii; Hitoshi Miyasaka; Hiroyuki Matsuzaka; Masahiro Yamashita; Hiroshi Okamoto; Hiroshi Kitagawa; Motoo Shiro; Koshiro Toriumi Syntheses and Physical Properties of Quasi-One-Dimensional Halogen-Bridged CuII-PtIV Mixed-Metal Complexes [Cu(chxn)2][PtX2(chxn)2]X4 Inorganic Chemistry 40 (2001) 6651-6655 Space group: I 2 2 2 Cell volume: 847.7 Cell parameters: 24.237; 5.103; 6.854; 90; 90; 90; |
| COD ID: 4321934 | |
| CIF file | Formula: - C12 H28 Cl N6 Ni O6 - Comments: Masahiro Yamashita; Toshio Manabe; Kazuo Inoue; Takuya Kawashima; Hiroshi Okamoto; Hiroshi Kitagawa; Tadaoki Mitani; Koshiro Toriumi; Hiroshi Miyamae; Ryuichi Ikeda Tuning of Spin Density Wave Strengths in Quasi-One-Dimensional Halogen-Bridged NiIII Complexes with Strong Electron Correlations, [NiIII(chxn)2X]Y2 Inorganic Chemistry 38 (1999) 1894-1899 Space group: I 2 2 2 Cell volume: 916.4 Cell parameters: 8.001; 22.99; 4.982; 90; 90; 90; |
| COD ID: 4324180 | |
| CIF file | Formula: - C20 H28 Cl2 N12 O2 Pd S2 - Comments: Adam Duong; Thierry Maris; James D. Wuest Using Pyridinyl-Substituted Diaminotriazines to Bind Pd(II) and Create Metallotectons for Engineering Hydrogen-Bonded Crystals Inorganic Chemistry 50 (2011) 5605-5618 Space group: I 2 2 2 Cell volume: 1240.7 Cell parameters: 3.7721; 11.346; 28.99; 90; 90; 90; |
| COD ID: 4325009 | |
| CIF file | Formula: - C24 H67 Cl6.75 Fe7.25 N6 O17 - Comments: Shreya Mukherjee; Rashmi Bagai; Khalil A. Abboud; George Christou Raising the Spin of FeIII7 Disklike Clusters: The Power of Molecular Spin Frustration Inorganic Chemistry 50 (2011) 3849-3851 Space group: I 2 2 2 Cell volume: 10205.8 Cell parameters: 20.8859; 21.5851; 22.638; 90; 90; 90; |
| COD ID: 4325281 | |
| CIF file | Formula: - C26.8 H57 N4 Ni5 O20.7 - Comments: Tereza Peristeraki; Marianna Samios; Milosz Siczek; Tadeusz Lis; Constantinos J. Milios Artificial Amino Acids in Nickel(II) and Nickel(II)/Lanthanide(III) Chemistry Inorganic Chemistry 50 (2011) 5175-5185 Space group: I 2 2 2 Cell volume: 5022 Cell parameters: 13.172; 17.242; 22.112; 90; 90; 90; |
| COD ID: 4329133 | |
| CIF file | Formula: - C40 H32 Cr2 F4 N16 Nd2 O24 - Comments: Torben Birk; Kasper S. Pedersen; Christian Aa. Thuesen; Thomas Weyhermüller; Magnus Schau-Magnussen; Stergios Piligkos; Högni Weihe; Susanne Mossin; Marco Evangelisti; Jesper Bendix Fluoride Bridges as Structure-Directing Motifs in 3d-4f Cluster Chemistry Inorganic Chemistry 51 (2012) 5435-5443 Space group: I 2 2 2 Cell volume: 2958.6 Cell parameters: 12.2727; 15.3327; 15.7225; 90; 90; 90; |
| COD ID: 4339780 | |
| CIF file | Formula: - C144 H134 Mn16 N72 O63 - Comments: Dey, Subrata K.; Abedin, Tareque S. M.; Dawe, Louise N.; Tandon, Santokh S.; Collins, Julie L.; Thompson, Laurence K.; Postnikov, Andrei V.; Alam, Mohammad S.; Müller, Paul Supramolecular self-assembled polynuclear complexes from tritopic, tetratopic, and pentatopic ligands: structural, magnetic and surface studies. Inorganic chemistry 46(19) (2007) 7767-7781 Space group: I 2 2 2 Cell volume: 9600 Cell parameters: 13.27; 21.36; 33.87; 90; 90; 90; |
| COD ID: 4341246 | |
| CIF file | Formula: - C12 H28 Cd Cl4 N2 - Comments: Liao, Wei-Qiang; Ye, Heng-Yun; Fu, Da-Wei; Li, Peng-Fei; Chen, Li-Zhuang; Zhang, Yi Temperature-Triggered Reversible Dielectric and Nonlinear Optical Switch Based on the One-Dimensional Organic-Inorganic Hybrid Phase Transition Compound [C6H11NH3]2CdCl4. Inorganic chemistry 53(20) (2014) 11146-11151 Space group: I 2 2 2 Cell volume: 960.4 Cell parameters: 28.5482; 6.103; 5.512; 90; 90; 90; |
| COD ID: 4342747 | |
| CIF file | Formula: - C40 H56 Mn4 O17 - Comments: Hailili, Reshalaiti; Wang, Li; Qv, Junzhang; Yao, Ruxin; Zhang, Xian-Ming; Liu, Huwei Planar Mn4O Cluster Homochiral Metal-Organic Framework for HPLC Separation of Pharmaceutically Important (±)-Ibuprofen Racemate. Inorganic chemistry 54(8) (2015) 3713-3715 Space group: I 2 2 2 Cell volume: 2578 Cell parameters: 13.501; 13.724; 13.911; 90; 90; 90; |
| COD ID: 4500285 | |
| CIF file | Formula: - C14 H21 N2 Na O11 U - Comments: Thuéry, Pierre Uranyl−Organic Assemblies with Acetate-Bearing Phenyl- and Cyclohexyl-Based Ligands Crystal Growth & Design 11(1) (2011) 347 Space group: I 2 2 2 Cell volume: 4138.1 Cell parameters: 12.002; 12.6829; 27.185; 90; 90; 90; |
| COD ID: 4503406 | |
| CIF file | Formula: - C104 H128 Co2 N36 O52 - Comments: Li, Yitao; Meng, Xianggao; Cao, Liping; Wang, Yuzhou; Yin, Guodong; Gao, Meng; Wen, Lili; Wu, Anxin Self-Assembly of Discrete and Polymeric Metal-Organic Frameworks via a Semirigid Glycoluril-Based Molecular Clip Crystal Growth & Design 8(5) (2008) 1645 Space group: I 2 2 2 Cell volume: 3197.3 Cell parameters: 9.075; 12.1333; 29.037; 90; 90; 90; |
| COD ID: 4503407 | |
| CIF file | Formula: - C52 H78 N18 O27 Zn - Comments: Li, Yitao; Meng, Xianggao; Cao, Liping; Wang, Yuzhou; Yin, Guodong; Gao, Meng; Wen, Lili; Wu, Anxin Self-Assembly of Discrete and Polymeric Metal-Organic Frameworks via a Semirigid Glycoluril-Based Molecular Clip Crystal Growth & Design 8(5) (2008) 1645 Space group: I 2 2 2 Cell volume: 3220.9 Cell parameters: 12.144; 29.018; 9.1399; 90; 90; 90; |
| COD ID: 4504372 | |
| CIF file | Formula: - C4 H4 Mg O6 - Comments: Kam, Kinson C.; Young, Karen L. M.; Cheetham, Anthony K. Chemical and Structural Diversity in Chiral Magnesium Tartrates and their Racemic andMesoAnalogues Crystal Growth & Design 7(8) (2007) 1522 Space group: I 2 2 2 Cell volume: 569.3 Cell parameters: 5.1708; 9.359; 11.765; 90; 90; 90; |
| COD ID: 4505508 | |
| CIF file | Formula: - C38 H29 Co N6 O9 - Comments: Ali, Afsar; Hundal, Geeta; Gupta, Rajeev Co3±Based Building Blocks with Appended Phenol and Catechol Groups: Examples of Placing Hydrogen-Bond Donors and Acceptors in a Single Molecule Crystal Growth & Design 12(3) (2012) 1308 Space group: I 2 2 2 Cell volume: 2306.1 Cell parameters: 10.039; 15.446; 14.872; 90; 90; 90; |
| COD ID: 4505509 | |
| CIF file | Formula: - C38 H29 Co N6 O13 - Comments: Ali, Afsar; Hundal, Geeta; Gupta, Rajeev Co3±Based Building Blocks with Appended Phenol and Catechol Groups: Examples of Placing Hydrogen-Bond Donors and Acceptors in a Single Molecule Crystal Growth & Design 12(3) (2012) 1308 Space group: I 2 2 2 Cell volume: 2389.43 Cell parameters: 10.3708; 15.3526; 15.0072; 90; 90; 90; |
| COD ID: 4516565 | |
| CIF file | Formula: - C33 H37 N2 O8 Zn2 - Comments: Nguyen, Edward T.; Zhao, Xiang; Ta, Daniel; Nguyen, Phuong-Lan; Bu, Xianhui Comparative Study of In Situ and Presynthesized X-Pillar Ligand in Self-Assembly of Homochiral Porous Frameworks Crystal Growth & Design 15(12) (2015) 5939 Space group: I 2 2 2 Cell volume: 11116.3 Cell parameters: 18.4486; 19.2044; 31.3758; 90; 90; 90; |
| COD ID: 4518948 | |
| CIF file | Formula: - C120 H66 Eu2 N24 O16 Ru2 - Comments: Weng, Zhen-Zhang; Xu, Han; Zhang, Wei; Zhuang, Gui-Lin; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun Enantioselective Recognition and Separation of <i>C</i><sub>2</sub> Symmetric Substances via Chiral Metal-Organic Frameworks. ACS applied materials & interfaces 13(31) (2021) 37412-37421 Space group: I 2 2 2 Cell volume: 61245 Cell parameters: 36.922; 39.257; 42.254; 90; 90; 90; |
| COD ID: 4518949 | |
| CIF file | Formula: - C120 H66 Eu2 N24 O16 Ru2 - Comments: Weng, Zhen-Zhang; Xu, Han; Zhang, Wei; Zhuang, Gui-Lin; Long, La-Sheng; Kong, Xiang-Jian; Zheng, Lan-Sun Enantioselective Recognition and Separation of <i>C</i><sub>2</sub> Symmetric Substances via Chiral Metal-Organic Frameworks. ACS applied materials & interfaces 13(31) (2021) 37412-37421 Space group: I 2 2 2 Cell volume: 61337 Cell parameters: 37.1447; 38.972; 42.3711; 90; 90; 90; |
| COD ID: 6000747 | |
| CIF file | Formula: - Al10 Cl2 H16 K12 O48 Si10 - Comments: Christensen, A. N.; Fjellvag, H. Crystal structure determination of zeolite n from synchrotron X-ray powder diffraction data Acta Chemica Scandinavica 51 (1997) 969-973 Space group: I 2 2 2 Cell volume: 1281.67 Cell parameters: 9.9041; 9.886; 13.09; 90; 90; 90; |
| COD ID: 7001472 | |
| CIF file | Formula: - C22 H78 F2 Mg6 O22 - Comments: Wuttke, Stefan; Lehmann, Anja; Scholz, Gudrun; Feist, Michael; Dimitrov, Anton; Troyanov, Sergey I.; Kemnitz, Erhard Investigation of the fluorolysis of magnesium methoxide Dalton Transactions (issue 24) (2009) 4729-4734 Space group: I 2 2 2 Cell volume: 2366.4 Cell parameters: 11.6887; 11.7792; 17.1875; 90; 90; 90; |
| COD ID: 7001649 | |
| CIF file | Formula: - C8 H40 B5 Co4 N5 O26 P4 - Comments: Lin, Zhuojia; Wragg, David S.; Lightfoot, Philip; Morris, Russell E. A novel non-centrosymmetric metallophosphate-borate compound via ionothermal synthesis Dalton Transactions (issue 27) (2009) 5287-5289 Space group: I 2 2 2 Cell volume: 1775.4 Cell parameters: 6.7601; 7.5422; 34.822; 90; 90; 90; |
| COD ID: 7013569 | |
| CIF file | Formula: - C88 H92 Cl8 Mo4 N8 O20 - Comments: Berry, John F.; Cotton, F. Albert; Ibragimov, Sergey A.; Murillo, Carlos A.; Wang, Xiaoping A molecular loop with interstitial channels in a chiral environment: exploration of the chemistry of Mo24+ species with chiral and non-chiral dicarboxylate anions Dalton Transactions (issue 22) (2003) 4297 Space group: I 2 2 2 Cell volume: 10632 Cell parameters: 13.97; 20.45; 37.216; 90; 90; 90; |
| COD ID: 7033310 | |
| CIF file | Formula: - C10 H44 Ga2 Mn3 N10 O2 S10 Sn2 - Comments: Yue, Cheng-Yang; Lei, Xiao-Wu; Feng, Li-Juan; Wang, Chen; Gong, Ya-Ping; Liu, Xin-Ying [Mn2Ga4Sn4S20](8-) T3 supertetrahedral nanocluster directed by a series of transition metal complexes. Dalton transactions (Cambridge, England : 2003) 44(5) (2015) 2416-2424 Space group: I 2 2 2 Cell volume: 4129.1 Cell parameters: 10.9793; 16.526; 22.757; 90; 90; 90; |
| COD ID: 7039382 | |
| CIF file | Formula: - C48 H74 Cl Cu2 Dy N10 O14 S4 - Comments: Nguyen, H. H.; Jegathesh, J. J.; Takiden, A.; Hauenstein, D.; Pham, C. T.; Le, C. D.; Abram, U. 2,6-Dipicolinoylbis(N,N-dialkylthioureas) as versatile building blocks for oligo- and polynuclear architectures. Dalton transactions (Cambridge, England : 2003) 45(26) (2016) 10771-10779 Space group: I 2 2 2 Cell volume: 3433.3 Cell parameters: 11.4359; 16.1026; 18.6442; 90; 90; 90; |
| COD ID: 7045626 | |
| CIF file | Formula: - C36 H18 O16 U2 - Comments: Xu, Wei; Ren, Ya-Nan; Xie, Miao; Zhou, Lin-Xia; Zheng, Yue-Qing Six uranyl-organic frameworks with naphthalene-dicarboxylic acid and bipyridyl-based spacers: syntheses, structures, and properties. Dalton transactions (Cambridge, England : 2003) 47(12) (2018) 4236-4250 Space group: I 2 2 2 Cell volume: 11201 Cell parameters: 19.196; 27.013; 21.601; 90; 90; 90; |
| COD ID: 7048470 | |
| CIF file | Formula: - C64 H36 Cl2 Dy0.5 N6 O2 - Comments: Sun, Nana; Wang, Hailong; Liu, Tao; Qi, Dongdong; Jiang, Jianzhuang Magnetic investigations over reversibly switched chiral (phthalocyaninato)(porphyrinato) dysprosium double-decker compounds. Dalton transactions (Cambridge, England : 2003) 48(5) (2019) 1586-1590 Space group: I 2 2 2 Cell volume: 11078 Cell parameters: 21.695; 21.7955; 23.4279; 90; 90; 90; |
| COD ID: 7052163 | |
| CIF file | Formula: - C68 H80 Cl2 Cu2 N8 O12 - Comments: Pallavicini, Piersandro; Boiocchi, Massimo; Dacarro, Giacomo; Mangano, Carlo Enhanced kinetic inertness in the electrochemical interconversion of Cu(i) double helical to Cu(ii) monomeric complexes New Journal of Chemistry 31(6) (2007) 927 Space group: I 2 2 2 Cell volume: 3527.8 Cell parameters: 13.8593; 12.171; 20.914; 90; 90; 90; |
| COD ID: 7057123 | |
| CIF file | Formula: - C17 H24 Bi I5 N2 - Comments: Kotov, Vitalii Yu.; Ilyukhin, Andrey B.; Korlyukov, Alexander A.; Smol’yakov, Alexander F.; Kozyukhin, Sergey A. Black hybrid iodobismuthate containing linear anionic chains New Journal of Chemistry 42(8) (2018) 6354 Space group: I 2 2 2 Cell volume: 2668.02 Cell parameters: 12.2018; 13.4499; 16.2572; 90; 90; 90; |
| COD ID: 7102778 | |
| CIF file | Formula: - C40 H58 Cu3 N16 O27 V10 - Comments: Lan, Ya-Qian; Li, Shun-Li; Su, Zhong-Min; Shao, Kui-Zhan; Ma, Jian-Fang; Wang, Xin-Long; Wang, En-Bo Spontaneous resolution of a 3D chiral polyoxometalate-based polythreaded framework consisting of an achiral ligand Chemical Communications (Cambridge, United Kingdom) (issue 1) (2008) 58-60 Space group: I 2 2 2 Cell volume: 13337.2 Cell parameters: 23.067; 23.176; 24.948; 90; 90; 90; |
| COD ID: 7102779 | |
| CIF file | Formula: - C40 H58 Cu3 N16 O27 V10 - Comments: Lan, Ya-Qian; Li, Shun-Li; Su, Zhong-Min; Shao, Kui-Zhan; Ma, Jian-Fang; Wang, Xin-Long; Wang, En-Bo Spontaneous resolution of a 3D chiral polyoxometalate-based polythreaded framework consisting of an achiral ligand Chemical Communications (Cambridge, United Kingdom) (issue 1) (2008) 58-60 Space group: I 2 2 2 Cell volume: 13337.2 Cell parameters: 23.067; 23.176; 24.948; 90; 90; 90; |
| COD ID: 7104064 | |
| CIF file | Formula: - C46 H44 Cu2 O20 - Comments: Cui, Yong; Ngo, Helen L.; White, Peter S.; Lin, Wenbin Homochiral 3D open frameworks assembled from 1- and 2-D coordination polymers Chemical Communications (Cambridge, United Kingdom) (issue 8) (2003) 994-995 Space group: I 2 2 2 Cell volume: 3060 Cell parameters: 10.92; 14.03; 19.96; 90; 90; 90; |
| COD ID: 7108224 | |
| CIF file | Formula: - C150 Co5 N10 O41 Zn4 - Comments: Teng Zhang; Feijie Song; Wenbin Lin Blocking bimolecular activation pathways leads to different regioselectivity in metal-organic framework catalysis Chem.Commun. 48 (2012) 8766 Space group: I 2 2 2 Cell volume: 17427.9 Cell parameters: 17.9269; 19.2699; 50.45; 90; 90; 90; |
| COD ID: 7108449 | |
| CIF file | Formula: - C30 H42.5 Fe N4 O8.25 - Comments: Wolfgang Bauer; Stephan Schlamp; Birgit Weber A Ladder type Iron(II) Coordination Polymer with Cooperative Spin Transition Chem.Commun. 48 (2012) 10222 Space group: I 2 2 2 Cell volume: 6961.4 Cell parameters: 13.728; 19.597; 25.876; 90; 90; 90; |
| COD ID: 7112342 | |
| CIF file | Formula: - C100 H164 Cu2 N8 O16 - Comments: do Pim, Walace D.; Oliveira, Willian X. C.; Ribeiro, Marcos A.; de Faria, Érica N; Teixeira, Ivo F.; Stumpf, Humberto O.; Lago, Rochel M.; Pereira, Cynthia L. M.; Pinheiro, Carlos B.; Figueiredo, Jr, João C D; Nunes, Wallace C.; de Souza, Patterson P.; Pedroso, Emerson F.; Castellano, María; Cano, Joan; Julve, Miguel A pH-triggered bistable copper(II) metallacycle as a reversible emulsion switch for biphasic processes. Chemical communications (Cambridge, England) 49(92) (2013) 10778-10780 Space group: I 2 2 2 Cell volume: 5347.84 Cell parameters: 14.2234; 17.5944; 21.3698; 90; 90; 90; |
| COD ID: 7114393 | |
| CIF file | Formula: - C42.5 H41 Cl2.5 D0.5 Ir N O P2 - Comments: Carmona, Daniel; Ferrer, Joaquina; Lorenzo, Mónica; Santander, Manuel; Ponz, Sergio; Lahoz, Fernando J.; López, José A.; Oro, Luis A. Diastereoselective formation of chiral iridium hydrides containing the chiral P,N-chelate ligand (4S)-2-(2-(diphenylphosphino)phenyl)-4-isopropyl-1,3-oxazolineElectronic supplementary information (ESI) available: selected analytical and spectroscopic data for 1. See http://www.rsc.org/suppdata/cc/b2/b200518b/ Chemical Communications (issue 8) (2002) 870 Space group: I 2 2 2 Cell volume: 7676.8 Cell parameters: 17.371; 18.477; 23.918; 90; 90; 90; |
| COD ID: 7116724 | |
| CIF file | Formula: - C48 H56 Lu N3 P2 - Comments: Rong, Weifeng; He, Dongliang; Wang, Meiyan; Mou, Zehuai; Cheng, Jianhua; Yao, Changguang; Li, Shihui; Trifonov, Alexander A.; Lyubov, Dmitrii M.; Cui, Dongmei Neutral binuclear rare-earth metal complexes with four μ2-bridging hydrides Chemical Communications (Cambridge, United Kingdom) 51(24) (2015) 5063-5065 Space group: I 2 2 2 Cell volume: 4795.8 Cell parameters: 13.164; 18.573; 19.615; 90; 90; 90; |
| COD ID: 7116725 | |
| CIF file | Formula: - C108 H112 N6 P4 Y2 - Comments: Rong, Weifeng; He, Dongliang; Wang, Meiyan; Mou, Zehuai; Cheng, Jianhua; Yao, Changguang; Li, Shihui; Trifonov, Alexander A.; Lyubov, Dmitrii M.; Cui, Dongmei Neutral binuclear rare-earth metal complexes with four μ2-bridging hydrides Chemical Communications (Cambridge, United Kingdom) 51(24) (2015) 5063-5065 Space group: I 2 2 2 Cell volume: 4843.2 Cell parameters: 13.1802; 18.73; 19.619; 90; 90; 90; |
| COD ID: 7116850 | |
| CIF file | Formula: - C136 H96 N16 O16 Zn4 - Comments: Stephane A. Baudron; Herve Ruffin; Mir Wais Hosseini On Zn(II) 2,2'-bisdipyrrin circular helicates Chem.Commun. 51 (2015) 5906 Space group: I 2 2 2 Cell volume: 7166.4 Cell parameters: 15.3648; 19.7305; 23.6393; 90; 90; 90; |
| COD ID: 7116851 | |
| CIF file | Formula: - C136 H96 N16 O16 Zn4 - Comments: Stephane A. Baudron; Herve Ruffin; Mir Wais Hosseini On Zn(II) 2,2'-bisdipyrrin circular helicates Chem.Commun. 51 (2015) 5906 Space group: I 2 2 2 Cell volume: 7156.2 Cell parameters: 15.337; 19.7279; 23.6518; 90; 90; 90; |
| COD ID: 7117859 | |
| CIF file | Formula: - C24 H16 Cr2 N4 Ni O7 - Comments: Hayley S. Scott; Alankriti Bajpai; Kai-Jie Chen; Tony Pham; Brian Space; John J. Perry,IV; Michael J. Zaworotko Novel mode of 2-fold interpenetration observed in a primitive cubic network of formula [Ni(1,2-bis(4-pyridyl)acetylene)2(Cr2O7)]n Chem.Commun. 51 (2015) 14832 Space group: I 2 2 2 Cell volume: 2828.5 Cell parameters: 8.5465; 15.9683; 20.726; 90; 90; 90; |
| COD ID: 7120236 | |
| CIF file | Formula: - C46 H60 Cd Cl2 N4 O14 - Comments: Zhao, Si-Si; Chen, Li; Wang, Lei; Xie, Zhigang Two tetraphenylethene-containing coordination polymers for reversible mechanochromism Chem. Commun. (2017) Space group: I 2 2 2 Cell volume: 3046 Cell parameters: 12.0617; 14.2056; 17.7773; 90; 90; 90; |
| COD ID: 7121962 | |
| CIF file | Formula: - C204 H192 B5 F20 N36 Ni4 - Comments: Bao, Ling-Yu; Hao, Si-Jia; Xi, Sai-Fei; Yan, Xiaodong; Zhang, Hai-Xia; Shen, Rui; Gu, Zhi-Guo Chiral supramolecular coordination cages as high-performance inhibitors against amyloid-β aggregation. Chemical communications (Cambridge, England) 54(63) (2018) 8725-8728 Space group: I 2 2 2 Cell volume: 12728.6 Cell parameters: 19.7257; 25.1015; 25.7068; 90; 90; 90; |
| COD ID: 7123231 | |
| CIF file | Formula: - C416 H544 B8 O257 Zn4 - Comments: Hou, Caixia; Rohr, Jürgen; Parkin, Sean; Tsodikov, Oleg V. How mithramycin stereochemistry dictates its structure and DNA binding function. MedChemComm 10(5) (2019) 735-741 Space group: I 2 2 2 Cell volume: 16635.2 Cell parameters: 18.7382; 28.3032; 31.3664; 90; 90; 90; |
| COD ID: 7124083 | |
| CIF file | Formula: - C21 H16 Cl N3 Pt - Comments: Yang, Jing; Sun, Lili; Hao, Liang; Yang, Gang-Gang; Zou, Zhi-Cong; Cao, Qian; Ji, Liang-Nian; Mao, Zong-Wan A halogen ion-selective phosphorescence turn-on probe based on induction of Pt‒Pt interactions Chemical Communications (2019) Space group: I 2 2 2 Cell volume: 1064.91 Cell parameters: 3.6808; 15.8713; 18.2288; 90; 90; 90; |
| COD ID: 7125121 | |
| CIF file | Formula: - C30 H55 Au3 Co2 N6 O18 S6 Zn - Comments: Surinwong, Sireenart; Yoshinari, Nobuto; Kojima, Tatsuhiro; Konno, Takumi A drastic change in the superhydrophilic crystal porosities of metallosupramolecular structures via a slight change in pH. Chemical communications (Cambridge, England) 52(87) (2016) 12893-12896 Space group: I 2 2 2 Cell volume: 5188 Cell parameters: 10.307; 18.544; 27.144; 90; 90; 90; |
| COD ID: 7127814 | |
| CIF file | Formula: - C114 H154 Mg5 N8 - Comments: de Bruin-Dickason, Caspar N; Rosengarten, Christopher A.; Deacon, Glen B.; Jones, Cameron Enantiopure dimagnesium(i) and magnesium(ii) hydride complexes incorporating chiral amidinate or β-diketiminate ligands. Chemical communications (Cambridge, England) 57(13) (2021) 1599-1602 Space group: I 2 2 2 Cell volume: 5300.2 Cell parameters: 14.8055; 18.0071; 19.8803; 90; 90; 90; |
| COD ID: 7201511 | |
| CIF file | Formula: - C228 H149.5 Cl0.5 N18 Zn2 - Comments: Konarev, Dmitri V.; Khasanov, Salavat S.; Slovokhotov, Yury L.; Saito, Gunzi; Lyubovskaya, Rimma N. Neutral and ionic complexes of C60 with (ZnOEP)2·BPy coordination dimers CrystEngComm 10(1) (2008) 48 Space group: I 2 2 2 Cell volume: 7627.6 Cell parameters: 14.8555; 21.215; 24.2022; 90; 90; 90; |
| COD ID: 7203222 | |
| CIF file | Formula: - Cl4 Co3 H54 N33 - Comments: Pal Sharma, Raj; Bala, Ritu; Sharma, Rajni; Venugopalan, Paloth ‘Rings and rectangles’ mediated through weak interactions in ionic solids: Synthesis and packing analysis of [Co(NH3)6]Cl2SeCN and [Co(NH3)6]3Cl4(N3)5 in the crystalline state CrystEngComm 8(3) (2006) 215 Space group: I 2 2 2 Cell volume: 1667.3 Cell parameters: 7.115; 10.121; 23.154; 90; 90; 90; |
| COD ID: 7207472 | |
| CIF file | Formula: - C50 H80 Cu4 N14 O24 - Comments: Lou, Benyong; Wei, Yongqin; Lin, Qi The dipeptide-based chiral binuclear complex capturing 4,4′-bipyridine to form a 3D supramolecular framework with a 1D channel CrystEngComm 14(6) (2012) 2040 Space group: I 2 2 2 Cell volume: 4119 Cell parameters: 11.202; 12.897; 28.51; 90; 90; 90; |
| COD ID: 7209475 | |
| CIF file | Formula: - B P S4 - Comments: Schaefer, H.; Weiss, A. Zur Kenntnis von Bortetrathiophosphat B P S4 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 18 (1963) 81-82 Space group: I 2 2 2 Cell volume: 265.776 Cell parameters: 5.6; 5.25; 9.04; 90; 90; 90; |
| COD ID: 7213043 | |
| CIF file | Formula: - C H Mo0.5 N0.5 O1.5 - Comments: Xu, Yan; Lu, Jianjiang; Goh, Ngoh K. Hydrothermal assembly and crystal structures of three novel open frameworks based on molybdenum(vi) oxides Journal of Materials Chemistry 9(7) (1999) 1599 Space group: I 2 2 2 Cell volume: 395.06 Cell parameters: 5.2702; 5.2674; 14.231; 90; 90; 90; |
| COD ID: 7219048 | |
| CIF file | Formula: - C24 H16 Ag In N4 O8 - Comments: Tan, Yan-Xi; He, Yan-Ping; Zhang, Jian High and Selective Sorption of C2 Hydrocarbons in Heterometal-Organic Frameworks Built from Tetrahedral Units RSC Adv. (2014) Space group: I 2 2 2 Cell volume: 1798.9 Cell parameters: 10.8851; 11.8615; 13.9326; 90; 90; 90; |
| COD ID: 7232435 | |
| CIF file | Formula: - C40 H28 F16 O14 Zn2 - Comments: Cheplakova, Anastasia M.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Vinogradov, Andrey S.; Karpov, Victor M.; Platonov, Vyacheslav E.; Fedin, Vladimir P. Structural diversity of zinc(ii) coordination polymers with octafluorobiphenyl-4,4′-dicarboxylate based on mononuclear, paddle wheel and cuboidal units CrystEngComm 21(15) (2019) 2524 Space group: I 2 2 2 Cell volume: 2367.31 Cell parameters: 10.2288; 15.2173; 15.2087; 90; 90; 90; |
| COD ID: 7234726 | |
| CIF file | Formula: - C16 H8 Dy0.5 N8 O12 Zn2 - Comments: Yu-Fei Li; Dan Wang; Zhuang Liao; Yang Kang; Wei-Hua Ding; Xiang-Jun Zheng; Lin-Pei Jin Luminescence tuning of the Dy-Zn metal-organic framework and its application in the detection of Fe(iii) ions Journal of Materials Chemistry C 4 (2016) 4211-4217 Space group: I 2 2 2 Cell volume: 2418.4 Cell parameters: 10.659; 12.327; 18.406; 90; 90; 90; |
| COD ID: 7245949 | |
| CIF file | Formula: - C30 H28 N4 O3 Zn1.5 - Comments: Wang, Xue-Zhi; Zhou, Chuang-Wei; Wang, Bei; Lai, Ya-Liang; Lian, Zhao-Xia; Liu, Yi-Tong; Li, Yan Yan; Zhou, Xiao-Ping Chiral two-dimensional metal–organic frameworks based on Zn(salen) ligands: subcomponent self-assembly and circularly polarised luminescence CrystEngComm 25(3) (2023) 484-489 Space group: I 2 2 2 Cell volume: 7595.53 Cell parameters: 29.9967; 17.1308; 14.7811; 90; 90; 90; |
| COD ID: 7245950 | |
| CIF file | Formula: - C30 H28 N4 O3 Zn1.5 - Comments: Wang, Xue-Zhi; Zhou, Chuang-Wei; Wang, Bei; Lai, Ya-Liang; Lian, Zhao-Xia; Liu, Yi-Tong; Li, Yan Yan; Zhou, Xiao-Ping Chiral two-dimensional metal–organic frameworks based on Zn(salen) ligands: subcomponent self-assembly and circularly polarised luminescence CrystEngComm 25(3) (2023) 484-489 Space group: I 2 2 2 Cell volume: 7653.14 Cell parameters: 14.7259; 17.3191; 30.0077; 90; 90; 90; |
| COD ID: 7701762 | |
| CIF file | Formula: - C50 H106 N8 O Si8 Sm2 - Comments: Kazeminejad, Neda; Münzfeld, Luca; Gamer, Michael T.; Roesky, Peter W. Mono- and bimetallic amidinate samarium complexes - synthesis, structure, and hydroamination catalysis. Dalton transactions (Cambridge, England : 2003) 48(23) (2019) 8153-8160 Space group: I 2 2 2 Cell volume: 7393 Cell parameters: 10.5585; 20.1286; 34.786; 90; 90; 90; |
| COD ID: 7703949 | |
| CIF file | Formula: - C64 H96 Mg Na2 O8 - Comments: Yeardley, Callum; Kennedy, Alan R.; Gros, Philippe C.; Touchet, Sabrina; Fairley, Michael; McLellan, Ross; Martínez-Martínez, Antonio J; O'Hara, Charles T Structural and metal-halogen exchange reactivity studies of sodium magnesiate biphenolate complexes. Dalton transactions (Cambridge, England : 2003) 49(16) (2020) 5257-5263 Space group: I 2 2 2 Cell volume: 3311 Cell parameters: 11.3684; 15.6863; 18.5667; 90; 90; 90; |
| COD ID: 7704152 | |
| CIF file | Formula: - H39 K3 Nb14 O58 Si - Comments: Zhang, Ting-Ting; Lin, Po-Han; Yu, Gui-Yang; Zhang, Xiao; Cui, Xiao-Bing Syntheses, characterization and properties of two new dodeca-niobates presenting unprecedented features. Dalton transactions (Cambridge, England : 2003) 49(19) (2020) 6495-6503 Space group: I 2 2 2 Cell volume: 2494.5 Cell parameters: 10.8913; 11.6608; 19.6414; 90; 90; 90; |
| COD ID: 7705961 | |
| CIF file | Formula: - C8 H14 Ag3 N3 O12 - Comments: Rendošová, Michaela; Gyepes, Róbert; Maruščáková, Ivana Cingeľová; Mudroňová, Dagmar; Sabolová, Danica; Kello, Martin; Vilková, Mária; Almáši, Miroslav; Huntošová, Veronika; Zemek, Ondřej; Vargová, Zuzana An in vitro selective inhibitory effect of silver(i) aminoacidates against bacteria and intestinal cell lines and elucidation of the mechanism of action by means of DNA binding properties, DNA cleavage and cell cycle arrest. Dalton transactions (Cambridge, England : 2003) 50(3) (2021) 936-953 Space group: I 2 2 2 Cell volume: 2978.8 Cell parameters: 11.753; 12.4417; 20.3709; 90; 90; 90; |
| COD ID: 7707332 | |
| CIF file | Formula: - C58 H60 Cl2 Co N8 O4 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 2928.2 Cell parameters: 11.907; 14.568; 16.881; 90; 90; 90; |
| COD ID: 7707333 | |
| CIF file | Formula: - C46 H40 Cl2 Co N4 O4 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 2951 Cell parameters: 11.926; 14.364; 17.229; 90; 90; 90; |
| COD ID: 7707334 | |
| CIF file | Formula: - C62 H76 Cl2 Co N8 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 2951.4 Cell parameters: 11.8964; 14.5101; 17.098; 90; 90; 90; |
| COD ID: 7707335 | |
| CIF file | Formula: - C62 H72 Cl2 Co N4 O4 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 3047 Cell parameters: 12.13; 14.882; 16.881; 90; 90; 90; |
| COD ID: 7707336 | |
| CIF file | Formula: - C54 H56 Cl2 Co N4 O4 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 3052.1 Cell parameters: 12.234; 14.694; 16.978; 90; 90; 90; |
| COD ID: 7707337 | |
| CIF file | Formula: - C58 H56 Cl2 Co N4 O4 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 2935.5 Cell parameters: 11.997; 14.189; 17.245; 90; 90; 90; |
| COD ID: 7707338 | |
| CIF file | Formula: - C46 H32 Cl2 Co N4 - Comments: Cui, Ruoyu; Niu, Helin; Sheng, Enhong Coordination-induced spontaneous resolution of a TPPE-based MOF and its use as a crystalline sponge in guest determination. Dalton transactions (Cambridge, England : 2003) 50(21) (2021) 7186-7190 Space group: I 2 2 2 Cell volume: 2982 Cell parameters: 11.969; 14.578; 17.092; 90; 90; 90; |
| COD ID: 8104363 | |
| CIF file | Formula: - Al10 O45.44 Rb9.8 Si10 - Comments: Baerlocher, C.; Barrer, R.M. The crystal structure of synthetic zeolite F Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 140 (1974) 10-26 Space group: I 2 2 2 Cell volume: 1315.69 Cell parameters: 9.978; 9.978; 13.215; 90; 90; 90; |
| COD ID: 9008255 | |
| CIF file | Formula: - Cu8 Fe2.15 S12 Sn2 Zn0.85 - Comments: Kudoh, Y.; Takeuchi, Y. The superstructure of stannoidite Zeitschrift fur Kristallographie 144 (1976) 145-160 Space group: I 2 2 2 Cell volume: 939.038 Cell parameters: 10.767; 5.411; 16.118; 90; 90; 90; |
| COD ID: 9009558 | |
| CIF file | Formula: - C4 Al N O12 Si5 - Comments: Sokolova, E. V.; Rybakov, V. B.; Pautov, L. A.; Pushcharovsky D Yu Structural changes in tsaregorodtsevite Doklady Akademii Nauk SSSR 332 (1993) 309-312 Space group: I 2 2 2 Cell volume: 716.749 Cell parameters: 8.984; 8.937; 8.927; 90; 90; 90; |
| COD ID: 9017830 | |
| CIF file | Formula: - C4 Al N O12 Si5 - Comments: Sokolova, E. V.; Rybakov, V. B.; Pautov, L. A. The crystal structure of a new natural tetramethylammonium aluminosilicate [N(CH3)4][Si2(Si0.5Al0.5)O6]2 Note: H atoms not located Soviet Physics Doklady 36 (1991) 267-269 Space group: I 2 2 2 Cell volume: 716.749 Cell parameters: 8.984; 8.937; 8.927; 90; 90; 90; |
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