Crystallography Open Database
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Searching space group like 'I b c a'
COD ID: 1505897 | |
CIF file | Formula: - C12 H20 N4 - Comments: Zonta, Cristiano; Crisma, Marco; De Lucchi, Ottorino; Motterle, Riccardo; Serafini, Siro Benzotriazole complexes with amines and phenol: cooperativity mediated by induction effects in the crystal state. Organic letters 8(8) (2006) 1577-1579 Space group: I b c a Cell volume: 2640 Cell parameters: 11.277; 11.841; 19.771; 90; 90; 90; |
COD ID: 1511447 | |
CIF file | Formula: - B Ba3 O12 P3 - Comments: Goezel, G.; Eisenmann, B.; Kizilyalli, M.; Kniep, R.; Roehr, C.; Asbrand, M. Borophosphate - eine vernachlaessigte Verbindungsklasse: Die Kristallstrukturen von M(II) (B P O5) (M(II)= Ca, Sr) und Ba3 (B P3 O12) Angewandte Chemie (German Edition) 106 (1994) 791-793 Space group: I b c a Cell volume: 2255.09 Cell parameters: 22.211; 14.296; 7.102; 90; 90; 90; |
COD ID: 1514834 | |
CIF file | Formula: - C18.87 H19.16 N2 O2 Zn - Comments: He, Chun-Ting; Tian, Jing-Yu; Liu, Si-Yang; Ouyang, Gangfeng; Zhang, Jie-Peng; Chen, Xiao-Ming A porous coordination framework for highly sensitive and selective solid-phase microextraction of non-polar volatile organic compounds Chemical Science 4(1) (2013) 351 Space group: I b c a Cell volume: 7765.2 Cell parameters: 13.9562; 23.5904; 23.5858; 90; 90; 90; |
COD ID: 1514835 | |
CIF file | Formula: - C12 H10 N2 O2 Zn - Comments: He, Chun-Ting; Tian, Jing-Yu; Liu, Si-Yang; Ouyang, Gangfeng; Zhang, Jie-Peng; Chen, Xiao-Ming A porous coordination framework for highly sensitive and selective solid-phase microextraction of non-polar volatile organic compounds Chemical Science 4(1) (2013) 351 Space group: I b c a Cell volume: 7785.2 Cell parameters: 13.9249; 23.653; 23.637; 90; 90; 90; |
COD ID: 1526589 | |
CIF file | Formula: - Al1.84 H4 Li1.29 Na0.518 O14 Si4.16 - Comments: Seryotkin, Yu.V.; Bakakin, V.V.; Bazhan, I.S. Crystal structure of lithium-sodium (Li0.7 Na0.3)-analcime Zhurnal Strukturnoi Khimii (Issue-No. from 1981) 42 (2001) 607-611 Space group: I b c a Cell volume: 2487.63 Cell parameters: 13.546; 13.546; 13.557; 90; 90; 90; |
COD ID: 1530400 | |
CIF file | Formula: - Br2 Nb3 Se10 - Comments: Meerschaut, A.; Grenouilleau, P.; Guemas, L.; Rouxel, J. Characterization of a mixed-chains one-dimensional compound Journal of Solid State Chemistry 70 (1987) 36-47 Space group: I b c a Cell volume: 12886.7 Cell parameters: 14.205; 23.7219; 38.243; 90; 90; 90; |
COD ID: 1535987 | |
CIF file | Formula: - Li4 N3 Ta - Comments: Niewa, R.; Zherebtsov, D.A.; Borrmann, H.; Kniep, R. Preparation and crystal structure of Li4 (Ta N3) Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 2505-2508 Space group: I b c a Cell volume: 676.525 Cell parameters: 4.915; 9.731; 14.145; 90; 90; 90; |
COD ID: 1541106 | |
CIF file | Formula: - Al0.9999 Na O6 Si1.9998 - Comments: Pechar, F. An x-ray diffraction refinement of the crystal structure of natural orthorhombic analcime ((Na Al Si2 O6) (H2 O)) Zeolites 8 (1988) 247-249 Space group: I b c a Cell volume: 2579.43 Cell parameters: 13.72; 13.715; 13.708; 90; 90; 90; |
COD ID: 1559294 | |
CIF file | Formula: - C44 H32 F12 N4 P2 - Comments: Kodama, Takuya; Kubo, Maiko; Shinji, Wataru; Ohkubo, Kei; Tobisu, Mamoru Phenylene-bridged bis(benzimidazolium) (BBIm2+): a dicationic organic photoredox catalyst Chemical Science (2020) Space group: I b c a Cell volume: 9098 Cell parameters: 17.9121; 22.9333; 22.1479; 90; 90; 90; |
COD ID: 1560699 | |
CIF file | Formula: - C29 H19 N3 Ni O6 - Comments: Wu, Yu; Lu, Lu; Feng, Jianshen; Li, Yulong; Sun, Yanchun; Ma, Aiqing Design and construction of diverse structures of coordination polymers: Photocatalytic properties Journal of Solid State Chemistry 245 (2017) 213-218 Space group: I b c a Cell volume: 11955.3 Cell parameters: 19.6025; 23.5274; 25.9223; 90; 90; 90; |
COD ID: 1563758 | |
CIF file | Formula: - C80 H96 B4 F16 N34 Ni2 - Comments: Singh, Sandhya; Brooker, Sally Correlations between ligand field ΔO, spin crossover T1/2 and redox potential Epa in a family of five dinuclear helicates Chemical Science (2021) Space group: I b c a Cell volume: 22542.5 Cell parameters: 19.9782; 29.8827; 37.7594; 90; 90; 90; |
COD ID: 2004759 | |
CIF file | Formula: - C27 H24 F12 N12 O P2 Ru - Comments: Breu, J.; Belser, P.; Yersin, H. Tris(4,4'-bipyrimidine)ruthenium(II) Bis(hexafluorophosphate) Acetone Solvate Acta Crystallographica Section C 52(4) (1996) 858-861 Space group: I b c a Cell volume: 7011 Cell parameters: 12.007; 18.708; 31.213; 90; 90; 90; |
COD ID: 2011647 | |
CIF file | Formula: - C98 H83 Ag B N P4 - Comments: Ellis, Dianne D.; Spek, Anthony L. Tetrakis(triphenylphosphine)silver(I) tetraphenylborate acetonitrile solvate Acta Crystallographica Section C 56(12) (2000) e547-e548 Space group: I b c a Cell volume: 15370 Cell parameters: 21.763; 22.955; 30.767; 90; 90; 90; |
COD ID: 2017049 | |
CIF file | Formula: - C26 H52 Cl2 N2 P2 Pt - Comments: Bungu, Peter N.; Otto, Stefanus <i>cis</i>-Dichloridobis{dimethyl[3-(9-phosphabicyclo[3.3.1]non-9-yl)propyl]amine-κ<i>P</i>}platinum(II) Acta Crystallographica Section C 65(4) (2009) m152-m155 Space group: I b c a Cell volume: 5932.5 Cell parameters: 14.9247; 19.0706; 20.8432; 90; 90; 90; |
COD ID: 2019682 | |
CIF file | Formula: - C20 H18 Cd N4 O4 - Comments: Li, Qiang; Wang, Hui-Ting; Ye, Qiong One- and two-dimensional Cd^II^ coordination polymers constructed from 2-(2-methyl-1<i>H</i>-benzimidazol-1-yl)acetate ligands Acta Crystallographica Section C 70(10) (2014) 992-997 Space group: I b c a Cell volume: 7816.5 Cell parameters: 14.7042; 14.0074; 37.95; 90; 90; 90; |
COD ID: 2022084 | |
CIF file | Formula: - C23 H20 Co N4 O5 - Comments: Xu, Zhong-Xuan; Ou, Chun-Yan; Zhang, Chun-Xue 3D semiconducting Co‒MOFs based on 5-(hydroxymethyl)isophthalic acid and imidazole derivatives: syntheses and crystal structures Acta Crystallographica Section C 76(5) (2020) Space group: I b c a Cell volume: 4703.7 Cell parameters: 17.1976; 16.7629; 16.3162; 90; 90; 90; |
COD ID: 2023002 | |
CIF file | Formula: - Gd K2 Mo O8 P - Comments: Zozulia, Valeriia; Terebilenko, Kateryna; Voinalovych, Artem; Potaskalov, Vadim; Slobodyanik, Mykola Crystal structure of a layered phosphate molybdate K<sub>2</sub>Gd(PO<sub>4</sub>)(MoO<sub>4</sub>). Acta crystallographica. Section E, Crystallographic communications 80(Pt 2) (2024) 117-119 Space group: I b c a Cell volume: 1678.35 Cell parameters: 6.9527; 19.7112; 12.2466; 90; 90; 90; |
COD ID: 2106745 | |
CIF file | Formula: - Bi P S4 - Comments: Zimmermann, H.; Nitsche, R.; Carpentier, C.D. The crystal structure of bismuth thiophosphate Bi P S4 Acta Crystallographica B (24,1968-38,1982) 31 (1975) 2003-2006 Space group: I b c a Cell volume: 2316.03 Cell parameters: 10.601; 11.112; 19.661; 90; 90; 90; |
COD ID: 2203989 | |
CIF file | Formula: - C40 H32 Cd2 N8 O12 V4 - Comments: Xian-Zhong Sun; Bao-Yu Wang; Ling-Yun Zhong μ-Tetravanadato-bis[bis(2,2'-bipyridine)cadmium(II)] Acta Crystallographica Section E 60(8) (2004) m1100-m1102 Space group: I b c a Cell volume: 9545 Cell parameters: 16.287; 17.201; 34.07; 90; 90; 90; |
COD ID: 2204393 | |
CIF file | Formula: - C8 H8 N2 O7 - Comments: Sun, Yu-Xi; Nie, Yi Ammonium 2,6-dicarboxyl-4-nitrophenol Acta Crystallographica, Section E 60(10) (2004) m1742-m1744 Space group: I b c a Cell volume: 1893.1 Cell parameters: 7.128; 13.46; 19.731; 90; 90; 90; |
COD ID: 2204596 | |
CIF file | Formula: - C34 H32 N4 - Comments: Jun-Wen Wang; Hai-Bin Song; Feng-Bo Xu; Qing-Shan Li; Zheng-Zhi Zhang 1,2-Bis(3,5-dimethylpyrazol-1-yl)-<i>anti</i>-[2.2]paracyclonaphthane Acta Crystallographica Section E 60(11) (2004) o2047-o2049 Space group: I b c a Cell volume: 10917 Cell parameters: 16.6732; 16.674; 39.267; 90; 90; 90; |
COD ID: 2205402 | |
CIF file | Formula: - C16 H20 Cl2 N2 Te - Comments: Beckmann, Jens; Dakternieks, Dainis; Duthie, Andrew; Mitchell, Cassandra An orthorhombic polymorph of dichlorobis[4-(dimethylamino)phenyl]tellurium Acta Crystallographica Section E 61(4) (2005) o986-o987 Space group: I b c a Cell volume: 6997.1 Cell parameters: 16.0504; 16.4302; 26.5331; 90; 90; 90; |
COD ID: 2206078 | |
CIF file | Formula: - C24 H16 N10 Zn - Comments: Sun, Bai-Wang; Du Lin Diazidobis(1,7-phenanthroline)zinc(II) Acta Crystallographica Section E 61(6) (2005) m1099-m1100 Space group: I b c a Cell volume: 4397.1 Cell parameters: 13.7823; 17.5908; 18.1368; 90; 90; 90; |
COD ID: 2207386 | |
CIF file | Formula: - C16 H20 N4 O S2 - Comments: Ya-Jie Xie 1,1'-Dimethyl-2,2'-[<i>p</i>-phenylenebis(methylenethio)]di-1<i>H</i>-imidazole monohydrate Acta Crystallographica Section E 61(11) (2005) o3538-o3539 Space group: I b c a Cell volume: 3599.2 Cell parameters: 13.1962; 15.049; 18.124; 90; 90; 90; |
COD ID: 2210404 | |
CIF file | Formula: - Bi K2 O8 P W - Comments: Igor V. Zatovsky; Katherina V. Terebilenko; Nikolay S. Slobodyanik; Vyacheslav N. Baumer; Oleg V. Shishkin K~2~Bi(PO~4~)(WO~4~) with a layered anionic substructure Acta Crystallographica Section E 62(9) (2006) i193-i195 Space group: I b c a Cell volume: 1729.69 Cell parameters: 19.7253; 12.4764; 7.0284; 90; 90; 90; |
COD ID: 2213016 | |
CIF file | Formula: - C22 H17 N3 O7 - Comments: Yang-Gen Hu; Gui-Hua Li; Ming-Hua Zhou Ethyl 6-methyl-2-(3-nitrophenoxy)-4-oxo-3-phenyl-3,4-dihydrofuro[2,3-<i>d</i>]pyrimidine-5-carboxylate Acta Crystallographica Section E 63(4) (2007) o1836-o1838 Space group: I b c a Cell volume: 8245.3 Cell parameters: 15.4932; 19.406; 27.424; 90; 90; 90; |
COD ID: 2220020 | |
CIF file | Formula: - Ho K2 O8 P W - Comments: Terebilenko, Katherina V.; Zatovsky, Igor V.; Baumer, Vyacheslav N.; Slobodyanik, Nikolay S.; Shishkin, Oleg V. K~2~Ho(PO~4~)(WO~4~) Acta Crystallographica Section E 64(11) (2008) i75 Space group: I b c a Cell volume: 1646.6 Cell parameters: 6.882; 12.1485; 19.695; 90; 90; 90; |
COD ID: 2222979 | |
CIF file | Formula: - Bi Cs2 O8 P W - Comments: Terebilenko, Kateryna V.; Zatovsky, Igor V.; Baumer, Vyacheslav N.; Slobodyanik, Nikolay S. Cs~2~Bi(PO~4~)(WO~4~) Acta Crystallographica Section E 65(9) (2009) i67 Space group: I b c a Cell volume: 1923.21 Cell parameters: 21.3144; 12.6352; 7.1412; 90; 90; 90; |
COD ID: 2224051 | |
CIF file | Formula: - K2 Mo O8 P Sm - Comments: Zhao, Dan; Li, Feifei; Cheng, Wendan; Zhang, Hao Dipotassium samarium(III) molybdate(VI) phosphate(V), K~2~Sm(MoO~4~)(PO~4~) Acta Crystallographica Section E 65(11) (2009) i78 Space group: I b c a Cell volume: 1706 Cell parameters: 12.345; 7.004; 19.733; 90; 90; 90; |
COD ID: 2226969 | |
CIF file | Formula: - C40 H27 K N4 O8 - Comments: Ng, Seik Weng (Quinoline-2-carboxylato-κ<i>O</i>)(quinoline-2-carboxylic acid-κ<i>O</i>)bis(quinoline-2-carboxylic acid-κ^2^<i>N</i>,<i>O</i>)potassium Acta Crystallographica Section E 66(8) (2010) m948 Space group: I b c a Cell volume: 6731.1 Cell parameters: 17.8679; 18.3617; 20.5162; 90; 90; 90; |
COD ID: 2228140 | |
CIF file | Formula: - C14 H19 N3 O2 S - Comments: Zhang, Yan-Ling; Hou, Xu-Feng; Zhang, Fu-Juan; Yang, Feng-Ling Ethyl 3-[2-(<i>p</i>-tolylcarbamothioyl)hydrazinylidene]butanoate Acta Crystallographica Section E 66(11) (2010) o2971 Space group: I b c a Cell volume: 6215.07 Cell parameters: 14.1747; 25.1439; 17.4381; 90; 90; 90; |
COD ID: 2230193 | |
CIF file | Formula: - C14 H19 N3 S - Comments: Zhang, Yan-Ling; Zhang, Xiao-Wei; Zhang, Fu-Juan 3-[(Cyclohexylidene)amino]-1-(4-methylphenyl)thiourea Acta Crystallographica Section E 67(5) (2011) o1268 Space group: I b c a Cell volume: 5775.3 Cell parameters: 14.9151; 22.5593; 17.1642; 90; 90; 90; |
COD ID: 2230957 | |
CIF file | Formula: - C6 H5 N3 O8 - Comments: Jin, Shou-Wen; Chen, Bing-Xia; Ge, Yu-Shuang; Yin, Hua-Bing; Fang, Yu-Ping Oxonium picrate Acta Crystallographica Section E 67(7) (2011) o1694 Space group: I b c a Cell volume: 1913.12 Cell parameters: 7.151; 19.8082; 13.5061; 90; 90; 90; |
COD ID: 2233009 | |
CIF file | Formula: - C18 H30 Co O16 - Comments: Han, Li-Jun; Yang, Shu-Ping; Fu, Lin-Lin; Gao, Hai-Lei Hexaaquacobalt(II) bis(5-acetyl-2-hydroxybenzoate) dihydrate Acta Crystallographica Section E 67(12) (2011) m1733 Space group: I b c a Cell volume: 4823.5 Cell parameters: 10.6238; 13.6271; 33.318; 90; 90; 90; |
COD ID: 2234202 | |
CIF file | Formula: - C25 H25 F N4 O S - Comments: Hu, Hai-Jun; Chen, Hong 7-Benzyl-3-(4-fluorophenyl)-2-propylamino-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-<i>d</i>]pyrimidin-4(3<i>H</i>)-one Acta Crystallographica Section E 68(4) (2012) o1097 Space group: I b c a Cell volume: 8954 Cell parameters: 17.921; 18.427; 27.114; 90; 90; 90; |
COD ID: 2237706 | |
CIF file | Formula: - C12 H8 Ba O5 - Comments: Zhao, Dan; Li, Fei Fei; Liang, Peng; Ren, Jun-Ran; Qiu, Shen Poly[μ-aqua-aqua-μ~4~-naphthalene-1,8-dicarboxylato-barium]: a layer structure Acta Crystallographica Section E 69(4) (2013) m219-m220 Space group: I b c a Cell volume: 2453.6 Cell parameters: 8.9643; 30.539; 8.9625; 90; 90; 90; |
COD ID: 2240516 | |
CIF file | Formula: - C22 H26 Co F6 N4 O4 P - Comments: McLauchlan, Craig C.; Kissel, Daniel S.; Herlinger, Albert W. Crystal structure of {2,2'-[<i>N</i>,<i>N</i>'-bis(pyridin-2-ylmethyl)cyclohexane-<i>trans</i>-1,2-diyldi(nitrilo)]diacetato}cobalt(III) hexafluoridophosphate Acta Crystallographica Section E 71(4) (2015) 380-384 Space group: I b c a Cell volume: 4543.2 Cell parameters: 13.9848; 14.6221; 22.2177; 90; 90; 90; |
COD ID: 2241737 | |
CIF file | Formula: - C52 H42 N8 O2 Si - Comments: Lessard, Beno?ît H.; Lough, Alan J.; Bender, Timothy P. Crystal structures of bis(phenoxy)silicon phthalocyanines: increasing π‒π interactions, solubility and disorder and no halogen bonding observed Acta Crystallographica Section E 72(7) (2016) 988-994 Space group: I b c a Cell volume: 9332.8 Cell parameters: 10.9239; 25.7282; 33.2065; 90; 90; 90; |
COD ID: 2310411 | |
CIF file | Formula: - H18 Na2 O12 Si - Comments: Jamieson, P.B.; Dent Glasser, L.S. Sodium Silicate Hydrates. II. The Crystal Structure of Na2 O (Si O2) (H2 O)9 Acta Crystallographica (1,1948-23,1967) 20 (1966) 688-693 Space group: I b c a Cell volume: 2319.21 Cell parameters: 11.74; 17.03; 11.6; 90; 90; 90; |
COD ID: 4001943 | |
CIF file | Formula: - C153 H169 In6 N27 O63 - Comments: Sava Gallis, Dorina F.; Rohwer, Lauren E. S.; Rodriguez, Mark A.; Nenoff, Tina M. Efficient Photoluminescence via Metal‒Ligand Alteration in a New MOFs Family Chemistry of Materials 26(9) (2014) 2943 Space group: I b c a Cell volume: 37501 Cell parameters: 32.092; 34.184; 34.184; 90; 90; 90; |
COD ID: 4025495 | |
CIF file | Formula: - C32 H24 N2 - Comments: Masahiro Yoshimura; Toshimitsu Muraoka; Hiroshi Nakatsuka; Hanmin Huang; Masato Kitamura Synthesis of 3,3'-Diaryl-Substituted 2,2'-Diamino-1,1'-binaphthyl and Its Derivatives Journal of Organic Chemistry 75 (2010) 4315-4318 Space group: I b c a Cell volume: 5063 Cell parameters: 6.79; 20.97; 35.56; 90; 90; 90; |
COD ID: 4032432 | |
CIF file | Formula: - C14 H12 F4 N3 O2 - Comments: Tretyakov, Evgeny V.; Fedyushin, Pavel A.; Panteleeva, Elena V.; Stass, Dmitri V.; Bagryanskaya, Irina Yu; Beregovaya, Irina V.; Bogomyakov, Artem S. Substitution of a Fluorine Atom in Perfluorobenzonitrile by a Lithiated Nitronyl Nitroxide. The Journal of organic chemistry 82(8) (2017) 4179-4185 Space group: I b c a Cell volume: 2916.3 Cell parameters: 10.4901; 10.6393; 26.13; 90; 90; 90; |
COD ID: 4032433 | |
CIF file | Formula: - C14 H12 F4 N3 O - Comments: Tretyakov, Evgeny V.; Fedyushin, Pavel A.; Panteleeva, Elena V.; Stass, Dmitri V.; Bagryanskaya, Irina Yu; Beregovaya, Irina V.; Bogomyakov, Artem S. Substitution of a Fluorine Atom in Perfluorobenzonitrile by a Lithiated Nitronyl Nitroxide. The Journal of organic chemistry 82(8) (2017) 4179-4185 Space group: I b c a Cell volume: 2927.21 Cell parameters: 10.3528; 10.8047; 26.1688; 90; 90; 90; |
COD ID: 4068983 | |
CIF file | Formula: - C22 H62 B2 O P2 Si4 Sn - Comments: Izod, Keith; Wills, Corinne; Clegg, William; Harrington, Ross W. Seven-Membered Cyclic Dialkylstannylene and -Plumbylene Compounds Stabilized by Agostic-type B−H···E Interactions [E = Sn, Pb] Organometallics 28(7) (2009) 2211 Space group: I b c a Cell volume: 7059 Cell parameters: 16.22; 20.048; 21.707; 90; 90; 90; |
COD ID: 4071294 | |
CIF file | Formula: - C46 H71 B Fe O2 P4 - Comments: Allen, Olivia R.; Dalgarno, Scott J.; Field, Leslie D.; Jensen, Paul; Turnbull, Anthony J.; Willis, Anthony C. Addition of CO2to Alkyl Iron Complexes, Fe(PP)2Me2 Organometallics 27(9) (2008) 2092 Space group: I b c a Cell volume: 9263.8 Cell parameters: 17.3563; 22.1987; 24.0438; 90; 90; 90; |
COD ID: 4071481 | |
CIF file | Formula: - C52 H70 N4 Na2 Zn2 - Comments: Clegg, William; García-Álvarez, Joaquín; García-Álvarez, Pablo; Graham, David V.; Harrington, Ross W.; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.; Russo, Luca Synthesis, Structural Authentication, and Structurally Defined Metalation Reactions of Lithium and Sodium DA-Zincate Bases (DA = diisopropylamide) with Phenylacetylene† Organometallics 27(11) (2008) 2654 Space group: I b c a Cell volume: 21070 Cell parameters: 22.42; 22.883; 41.069; 90; 90; 90; |
COD ID: 4072326 | |
CIF file | Formula: - C36 H60 B4 Cl2 N4 Y2 - Comments: Yuan, Yuanyuan; Chen, Yaofeng; Li, Guangyu; Xia, Wei Reactions of Boratabenzene Yttrium Complexes with KN(SiMe3)2: Salt Elimination and π-Ligand Displacement Organometallics 27(23) (2008) 6307 Space group: I b c a Cell volume: 8306 Cell parameters: 8.7156; 29.666; 32.126; 90; 90; 90; |
COD ID: 4083469 | |
CIF file | Formula: - C66 H90 B2 F8 N6 O6 Pt2 - Comments: Au, Richard H. W.; Fraser, Christopher S. A.; Eisler, Dana J.; Jennings, Michael C.; Puddephatt, Richard J. Binuclear Organoplatinum(IV) Complexes with Bridging Xylenediyl Groups: Formation of Supramolecular Polymers through Hydrogen Bonding Organometallics 28(6) (2009) 1719 Space group: I b c a Cell volume: 14325 Cell parameters: 18.6165; 27.4048; 28.0783; 90; 90; 90; |
COD ID: 4100571 | |
CIF file | Formula: - C289 H244 Cd32 N2 P2 S52 - Comments: Journal of the American Chemical Society (2005) Space group: I b c a Cell volume: 66636 Cell parameters: 26.3539; 34.515; 73.258; 90; 90; 90; |
COD ID: 4106688 | |
CIF file | Formula: - C40 H88 N4 O19 V6 - Comments: Dong Li; Jie Song; Panchao Yin; Silas Simotwo; Andrew J. Bassler; YuYu Aung; James E. Roberts; Kenneth I. Hardcastle; Craig L. Hill; Tianbo Liu Inorganic-Organic Hybrid Vesicles with Counterion- and pH-Controlled Fluorescent Properties Journal of the American Chemical Society 133 (2011) 14010-14016 Space group: I b c a Cell volume: 11924.3 Cell parameters: 20.8395; 23.0194; 24.8572; 90; 90; 90; |
COD ID: 4117989 | |
CIF file | Formula: - C61 H45 B Cu F24 N3 - Comments: Conor S. Smith; Kent R. Mann Exceptionally Long-Lived Luminescence from [Cu(I)(isocyanide)2(phen)]+ Complexes in Nanoporous Crystals Enables Remarkable Oxygen Gas Sensing Journal of the American Chemical Society 134 (2012) 8786-8789 Space group: I b c a Cell volume: 11769 Cell parameters: 14.606; 18.18; 44.321; 90; 90; 90; |
COD ID: 4122707 | |
CIF file | Formula: - Ce7 H434 K Mo100 O518 - Comments: Xuan, Weimin; Surman, Andrew J.; Miras, Haralampos N.; Long, De-Liang; Cronin, Leroy Controlling the Ring Curvature, Solution Assembly, and Reactivity of Gigantic Molybdenum Blue Wheels. Journal of the American Chemical Society 136(40) (2014) 14114 Space group: I b c a Cell volume: 93491 Cell parameters: 31.3443; 32.3864; 92.098; 90; 90; 90; |
COD ID: 4124637 | |
CIF file | Formula: - C Ag K O3 - Comments: Donohue, J.; Helmholz, L. The crystal structure of potassium silver carbonate, K Ag C O3 Journal of the American Chemical Society 66 (1944) 295-298 Space group: I b c a Cell volume: 692.119 Cell parameters: 20.23; 5.75; 5.95; 90; 90; 90; |
COD ID: 4127399 | |
CIF file | Formula: - C21 H15 N2 O5 Zn - Comments: Rouhani, Farzaneh; Rafizadeh-Masuleh, Fatemeh; Morsali, Ali Highly Electroconductive Metal-Organic Framework: Tunable by Metal Ion Sorption Quantity. Journal of the American Chemical Society 141(28) (2019) 11173-11182 Space group: I b c a Cell volume: 9041.2 Cell parameters: 17.635; 22.345; 22.944; 90; 90; 90; |
COD ID: 4130378 | |
CIF file | Formula: - C17 H28 F8 I2 N2 O6 S - Comments: Topić, Filip; Rissanen, Kari Systematic Construction of Ternary Cocrystals by Orthogonal and Robust Hydrogen and Halogen Bonds. Journal of the American Chemical Society 138(20) (2016) 6610-6616 Space group: I b c a Cell volume: 6119.8 Cell parameters: 11.9443; 19.5839; 26.1625; 90; 90; 90; |
COD ID: 4300172 | |
CIF file | Formula: - C46 H44 Cl7 Cr3 N12 O - Comments: Rodolphe Clérac; F. Albert Cotton; Lee M. Daniels; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual Linear Trichromium Complexes with Direct Cr to Cr Contacts. 2. Compounds with Cr3(dipyridylamide)43+ Cores Inorganic Chemistry 39 (2000) 752-756 Space group: I b c a Cell volume: 10371.3 Cell parameters: 16.122; 17.151; 37.508; 90; 90; 90; |
COD ID: 4300400 | |
CIF file | Formula: - C18 H26 Cl2 Hg N2 O8 S4 - Comments: Wei Lai; Steven M. Berry; Deborah C. Bebout; Raymond J. Butcher Investigation of Group 12 Metal Complexes with a Tridentate SNS Ligand by X-ray Crystallography and 1H NMR Spectroscopy Inorganic Chemistry 45 (2006) 571-581 Space group: I b c a Cell volume: 5280.5 Cell parameters: 13.5814; 14.184; 27.412; 90; 90; 90; |
COD ID: 4304925 | |
CIF file | Formula: - C6 H14 Ga N3 O12.5 P - Comments: Christian R. Samanamu; Marilyn M. Olmstead; Jean-Luc Montchamp; Anne F. Richards Convenient Synthesis of Aluminum and Gallium Phosphonate Cages Inorganic Chemistry 47 (2008) 3879-3887 Space group: I b c a Cell volume: 5685.7 Cell parameters: 9.223; 20.733; 29.734; 90; 90; 90; |
COD ID: 4308901 | |
CIF file | Formula: - Cs2 O8 Si2 U - Comments: Chih-Shan Chen; Ray-Kuang Chiang; Hsien-Ming Kao; Kwang-Hwa Lii High-Temperature, High-Pressure Hydrothermal Synthesis, Crystal Structure, and Solid-State NMR Spectroscopy of Cs2(UO2)(Si2O6) and Variable-Temperature Powder X-ray Diffraction Study of the Hydrate Phase Cs2(UO2)(Si2O6).0.5H2O Inorganic Chemistry 44 (2005) 3914-3918 Space group: I b c a Cell volume: 3797.2 Cell parameters: 15.1372; 15.2949; 16.401; 90; 90; 90; |
COD ID: 4311385 | |
CIF file | Formula: - C48 H31 Ag2 Cl2 N5 O8 - Comments: Chih-Chieh Wang; Cheng-Han Yang; Shih-Min Tseng; Sue-Yi Lin; Ti-Yu Wu; Ming-Ren Fuh; Gene-Hsiang Lee; Ken-Tsung Wong; Ruei-Tang Chen; Yi-Ming Cheng; Pi-Tai Chou Structural Characterization and Luminescence Behavior of a Silver(I) 1D Polymeric Chain Constructed via a Bridge with Unusual 4,5-Diazospirobifluorene and Perchlorate Inorganic Chemistry 43 (2004) 4781-4783 Space group: I b c a Cell volume: 8509.1 Cell parameters: 14.7025; 16.2288; 35.662; 90; 90; 90; |
COD ID: 4312746 | |
CIF file | Formula: - C12 H6 Br2.5 Cu0.75 O S11 - Comments: Takuya Matsumoto; Yohsuke Kamada; Toyonari Sugimoto; Toshiji Tada; Satoru Noguchi; Hiroyuki Nakazumi; Takashi Kawakami; Kizashi Yamaguchi; Motoo Shiro One-Dimensional CuBr42- Ion Array and CuBr3- Ion Chain Included in the π Conducting Framework Composed of Bis(methylthio)tetrathiafulvalenothioquinone- -1,3-dithiocarbonatodithiolemethide Molecules Inorganic Chemistry 42 (2003) 8638-8645 Space group: I b c a Cell volume: 8766 Cell parameters: 6.949; 38.09; 33.12; 90; 90; 90; |
COD ID: 4317363 | |
CIF file | Formula: - C78 H158 Cl6 Cu8 N24 Ni O55 - Comments: Marie-Claire Dul; Jesús Ferrando-Soria; Emilio Pardo; Rodrigue Lescouëzec; Yves Journaux; Rafael Ruiz-García; Joan Cano; Miguel Julve; Francesc Lloret; Oscar Fabelo; Jorge Pasán; Catalina Ruiz-Pérez Tuning the Spin Ground State in Heterononanuclear Nickel(II)-Copper(II) Cylinders with a Triangular Metallacyclophane Core Inorganic Chemistry 49 (2010) 11264-11266 Space group: I b c a Cell volume: 26116 Cell parameters: 25.653; 27.605; 36.879; 90; 90; 90; |
COD ID: 4318219 | |
CIF file | Formula: - C51 H31 Cl2 O22 Os6 P4 - Comments: Siau-Gek Ang; Zhong; How-Ghee Ang 1,2,3,4-Tetraphenyl-1,2,3,4-tetraphospholane, a Highly Versatile Cyclocarbaphosphine Ligand: Reactions with Activated Triosmium Clusters and Characterization of the Products Inorganic Chemistry 41 (2002) 3791-3800 Space group: I b c a Cell volume: 13022.5 Cell parameters: 13.4535; 24.7872; 39.0511; 90; 90; 90; |
COD ID: 4318956 | |
CIF file | Formula: - F10 I Sb - Comments: Ashwani Vij; Fook S. Tham; Vandana Vij; William W. Wilson; Karl O. Christe Structures of the BrF4+ and IF4+ Cations Inorganic Chemistry 41 (2002) 6397-6403 Space group: I b c a Cell volume: 1416.5 Cell parameters: 8.2702; 8.3115; 20.607; 90; 90; 90; |
COD ID: 4319597 | |
CIF file | Formula: - C15 H32 Br2 Cu N4 - Comments: Louise Broge; Ulla Pretzmann; Nicolai Jensen; Inger Søtofte; Carl Erik Olsen; Johan Springborg Cobalt(II), Nickel(II), Copper(II), and Zinc(II) Complexes with [35]Adamanzane, 1,5,9,13-Tetraazabicyclo[7.7.3]nonadecane, and [(2.3)2.21]Adamanzane, 1,5,9,12-Tetraazabicyclo[7.5.2]hexadecane Inorganic Chemistry 40 (2001) 2323-2334 Space group: I b c a Cell volume: 3766.4 Cell parameters: 13.251; 13.951; 20.374; 90; 90; 90; |
COD ID: 4319599 | |
CIF file | Formula: - C15 H32 Cl2 N4 Ni - Comments: Louise Broge; Ulla Pretzmann; Nicolai Jensen; Inger Søtofte; Carl Erik Olsen; Johan Springborg Cobalt(II), Nickel(II), Copper(II), and Zinc(II) Complexes with [35]Adamanzane, 1,5,9,13-Tetraazabicyclo[7.7.3]nonadecane, and [(2.3)2.21]Adamanzane, 1,5,9,12-Tetraazabicyclo[7.5.2]hexadecane Inorganic Chemistry 40 (2001) 2323-2334 Space group: I b c a Cell volume: 3582.6 Cell parameters: 12.693; 13.619; 20.725; 90; 90; 90; |
COD ID: 4319600 | |
CIF file | Formula: - C15 H32 Br2 N4 Ni - Comments: Louise Broge; Ulla Pretzmann; Nicolai Jensen; Inger Søtofte; Carl Erik Olsen; Johan Springborg Cobalt(II), Nickel(II), Copper(II), and Zinc(II) Complexes with [35]Adamanzane, 1,5,9,13-Tetraazabicyclo[7.7.3]nonadecane, and [(2.3)2.21]Adamanzane, 1,5,9,12-Tetraazabicyclo[7.5.2]hexadecane Inorganic Chemistry 40 (2001) 2323-2334 Space group: I b c a Cell volume: 3756.7 Cell parameters: 13.13; 13.859; 20.645; 90; 90; 90; |
COD ID: 4319602 | |
CIF file | Formula: - C15 H32 Cl2 Co N4 - Comments: Louise Broge; Ulla Pretzmann; Nicolai Jensen; Inger Søtofte; Carl Erik Olsen; Johan Springborg Cobalt(II), Nickel(II), Copper(II), and Zinc(II) Complexes with [35]Adamanzane, 1,5,9,13-Tetraazabicyclo[7.7.3]nonadecane, and [(2.3)2.21]Adamanzane, 1,5,9,12-Tetraazabicyclo[7.5.2]hexadecane Inorganic Chemistry 40 (2001) 2323-2334 Space group: I b c a Cell volume: 3601.2 Cell parameters: 12.738; 13.675; 20.674; 90; 90; 90; |
COD ID: 4320776 | |
CIF file | Formula: - C34 H42 F12 Fe N10 P2 - Comments: P. Manikandan; K. Padmakumar; K. R. Justin Thomas; B. Varghese; P. T. Manoharan Lattice-Dictated Conformers in Bis(pyrazolyl)pyridine-Based Iron(II) Complexes: Mössbauer, NMR, and Magnetic Studies Inorganic Chemistry 40 (2001) 6930-6939 Space group: I b c a Cell volume: 8238 Cell parameters: 12.6452; 15.361; 42.412; 90; 90; 90; |
COD ID: 4333740 | |
CIF file | Formula: - C90 H104 Cl4 N4 O P8 Ru2 - Comments: Leslie D. Field; Hsiu L. Li; Scott J. Dalgarno; Ruaraidh D. McIntosh Base-Induced Dehydrogenation of Ruthenium Hydrazine Complexes Inorganic Chemistry 52 (2013) 1570-1583 Space group: I b c a Cell volume: 16792.4 Cell parameters: 17.3284; 26.815; 36.139; 90; 90; 90; |
COD ID: 4335183 | |
CIF file | Formula: - C38 H39 Br4 Fe2 N7 P2 - Comments: Christopher J. Whiteoak; James D. Nobbs; Evgeny Kiryushchenkov; Sandro Pagano; Andrew J.P. White; George J.P. Britovsek Tri(pyridylmethyl)phosphine: The Elusive Congener of TPA Shows Surprisingly Different Coordination Behavior Inorganic Chemistry 52 (2013) 7000-7009 Space group: I b c a Cell volume: 8310.94 Cell parameters: 19.8229; 22.6568; 18.5048; 90; 90; 90; |
COD ID: 4335408 | |
CIF file | Formula: - C9 H20 P2 Se3 - Comments: Philip J. W. Elder; Tristram Chivers Chalcogenation of the 1,4-C2P4 Ring: Oxidation, Isomerization, Insertion, and Ring Contraction Inorganic Chemistry 52 (2013) 7791-7804 Space group: I b c a Cell volume: 2913.58 Cell parameters: 8.041; 18.8488; 19.2235; 90; 90; 90; |
COD ID: 4343074 | |
CIF file | Formula: - C40 H50 Fe N2 O4 U - Comments: Camp, Clément; Chatelain, Lucile; Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella Ferrocene-Based Tetradentate Schiff Bases as Supporting Ligands in Uranium Chemistry. Inorganic chemistry 54(12) (2015) 5774-5783 Space group: I b c a Cell volume: 7626.6 Cell parameters: 12.1057; 22.9932; 27.3994; 90; 90; 90; |
COD ID: 4346510 | |
CIF file | Formula: - C22 H26 F6 Ga N4 O4 P - Comments: Florián, Jan; McLauchlan, Craig C.; Kissel, Daniel S.; Eichman, Chad C.; Herlinger, Albert W. Metal Ion Complexes of N,N'-Bis(2-Pyridylmethyl)-trans-1,2-Diaminocyclohexane-N,N'-Diacetic Acid, H2bpcd: Cis/Trans Isomerization Equilibria. Inorganic chemistry 54(21) (2015) 10361-10370 Space group: I b c a Cell volume: 4663.5 Cell parameters: 13.8975; 15.0872; 22.2418; 90; 90; 90; |
COD ID: 4346824 | |
CIF file | Formula: - C12 H10 Ag2 N2 O5 - Comments: Yan, Zhi-Hao; Li, Xiao-Yu; Liu, Li-Wei; Yu, Si-Qi; Wang, Xing-Po; Sun, Di Single-Crystal to Single-Crystal Phase Transition and Segmented Thermochromic Luminescence in a Dynamic 3D Interpenetrated Ag(I) Coordination Network. Inorganic chemistry 55(3) (2016) 1096-1101 Space group: I b c a Cell volume: 5237.3 Cell parameters: 7.2349; 23.7112; 30.5299; 90; 90; 90; |
COD ID: 4346825 | |
CIF file | Formula: - C12 H10 Ag2 N2 O5 - Comments: Yan, Zhi-Hao; Li, Xiao-Yu; Liu, Li-Wei; Yu, Si-Qi; Wang, Xing-Po; Sun, Di Single-Crystal to Single-Crystal Phase Transition and Segmented Thermochromic Luminescence in a Dynamic 3D Interpenetrated Ag(I) Coordination Network. Inorganic chemistry 55(3) (2016) 1096-1101 Space group: I b c a Cell volume: 5294.9 Cell parameters: 7.2499; 23.7625; 30.735; 90; 90; 90; |
COD ID: 4346826 | |
CIF file | Formula: - C12 H10 Ag2 N2 O5 - Comments: Yan, Zhi-Hao; Li, Xiao-Yu; Liu, Li-Wei; Yu, Si-Qi; Wang, Xing-Po; Sun, Di Single-Crystal to Single-Crystal Phase Transition and Segmented Thermochromic Luminescence in a Dynamic 3D Interpenetrated Ag(I) Coordination Network. Inorganic chemistry 55(3) (2016) 1096-1101 Space group: I b c a Cell volume: 5267.8 Cell parameters: 7.2127; 23.7652; 30.732; 90; 90; 90; |
COD ID: 4346827 | |
CIF file | Formula: - C12 H10 Ag2 N2 O5 - Comments: Yan, Zhi-Hao; Li, Xiao-Yu; Liu, Li-Wei; Yu, Si-Qi; Wang, Xing-Po; Sun, Di Single-Crystal to Single-Crystal Phase Transition and Segmented Thermochromic Luminescence in a Dynamic 3D Interpenetrated Ag(I) Coordination Network. Inorganic chemistry 55(3) (2016) 1096-1101 Space group: I b c a Cell volume: 5230.9 Cell parameters: 7.1728; 23.7537; 30.701; 90; 90; 90; |
COD ID: 4346828 | |
CIF file | Formula: - C12 H10 Ag2 N2 O5 - Comments: Yan, Zhi-Hao; Li, Xiao-Yu; Liu, Li-Wei; Yu, Si-Qi; Wang, Xing-Po; Sun, Di Single-Crystal to Single-Crystal Phase Transition and Segmented Thermochromic Luminescence in a Dynamic 3D Interpenetrated Ag(I) Coordination Network. Inorganic chemistry 55(3) (2016) 1096-1101 Space group: I b c a Cell volume: 5226.1 Cell parameters: 7.162; 23.7651; 30.7049; 90; 90; 90; |
COD ID: 4349882 | |
CIF file | Formula: - C48 H44 N6 O6 Zn2 - Comments: He, Chun-Ting; Ye, Zi-Ming; Xu, Yan-Tong; Xie, Yi; Lian, Xin-Lu; Zhang, Jie-Peng; Chen, Xiao-Ming A flexible metal‒organic framework with adaptive pores for high column-capacity gas chromatographic separation Inorganic Chemistry Frontiers 5(11) (2018) 2777 Space group: I b c a Cell volume: 9117.6 Cell parameters: 17.2385; 22.536; 23.4694; 90; 90; 90; |
COD ID: 4349885 | |
CIF file | Formula: - C46.5 H44 N6 O6 Zn2 - Comments: He, Chun-Ting; Ye, Zi-Ming; Xu, Yan-Tong; Xie, Yi; Lian, Xin-Lu; Zhang, Jie-Peng; Chen, Xiao-Ming A flexible metal‒organic framework with adaptive pores for high column-capacity gas chromatographic separation Inorganic Chemistry Frontiers 5(11) (2018) 2777 Space group: I b c a Cell volume: 8882.9 Cell parameters: 16.688; 22.617; 23.535; 90; 90; 90; |
COD ID: 4501290 | |
CIF file | Formula: - C36 H33 N8 O16.5 Zr - Comments: Mouchaham, Georges; Roques, Nans; Brandès, Stéphane; Duhayon, Carine; Sutter, Jean-Pascal Self-Assembly of Zr(C2O4)44–Metallotectons and Bisimidazolium Cations: Influence of the Dication on H-Bonded Framework Dimensionality and Material Potential Porosity Crystal Growth & Design 11(12) (2011) 5424 Space group: I b c a Cell volume: 7758.2 Cell parameters: 15.8577; 21.8722; 22.3681; 90; 90; 90; |
COD ID: 4501420 | |
CIF file | Formula: - C54 H86 Cl N24 O40 Rb - Comments: Chen, Kai; Feng, Xing; Liang, Li-Li; Zhang, Yun-Qian; Zhu, Qian-Jiang; Xue, Sai-Feng; Tao, Zhu Coordination and Supramolecular Self-Assemblies of Alkali and Alkaline Earth Metal Ions to Cucurbit[5]uril in the Presence of Nitrophenol Crystal Growth & Design 11(12) (2011) 5712 Space group: I b c a Cell volume: 16033 Cell parameters: 17.787; 18.343; 49.14; 90; 90; 90; |
COD ID: 4501611 | |
CIF file | Formula: - C44 H38 Cd2 N5 O13 - Comments: Hu, Jin-Song; Shang, Yong-Jia; Yao, Xiao-qiang; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen; Xue, Zi-Ling Syntheses, Structures, and Photoluminescence of Five New Metal−Organic Frameworks Based on Flexible Tetrapyridines and Aromatic Polycarboxylate Acids Crystal Growth & Design 10(6) (2010) 2676 Space group: I b c a Cell volume: 9896.9 Cell parameters: 14.5739; 20.8969; 32.497; 90; 90; 90; |
COD ID: 4503788 | |
CIF file | Formula: - C26 H28 Cu4 I4 N4 - Comments: Chen, Yang; Li, Hong-Xi; Liu, Dong; Liu, Lei-Lei; Li, Ni-Ya; Ye, Huan-Ying; Zhang, Yong; Lang, Jian-Ping Solvent Effects on the Assembly of [Cu2I2]- or [Cu4I4]-Based Coordination Polymers: Isolation, Structures, and Luminescent Properties Crystal Growth & Design 8(10) (2008) 3810 Space group: I b c a Cell volume: 14774 Cell parameters: 15.666; 25.131; 37.527; 90; 90; 90; |
COD ID: 4505338 | |
CIF file | Formula: - C312 H368 Cl16 Mn8 N48 O16 - Comments: Ghosh, A. K.; Ghoshal, D.; Lu, T.-H.; Mostafa, G.; Chaudhuri, N. Ray Novel Solid-State Molecular Self-Assemblies of Manganese (II) Constructed with Flexible Ligands: Influences of π−π and C−H···π Interactions on Their Crystal Packing Crystal Growth & Design 4(4) (2004) 851 Space group: I b c a Cell volume: 7808 Cell parameters: 16.571; 26.888; 17.525; 90; 90; 90; |
COD ID: 4506890 | |
CIF file | Formula: - C29 H28 Co N4 O5 - Comments: Guo, Qianqian; Xu, Chunying; Zhao, Bei; Jia, Yanyuan; Hou, Hongwei; Fan, Yaoting Syntheses, Characterizations, and Properties of Five Interpenetrating Complexes Based on 1,4-Benzenedicarboxylic Acid and a Series of Benzimidazole-Based Linkers Crystal Growth & Design 12(11) (2012) 5439 Space group: I b c a Cell volume: 5220.8 Cell parameters: 16.173; 17.917; 18.017; 90; 90; 90; |
COD ID: 4506891 | |
CIF file | Formula: - C29 H30 N4 O5 Zn - Comments: Guo, Qianqian; Xu, Chunying; Zhao, Bei; Jia, Yanyuan; Hou, Hongwei; Fan, Yaoting Syntheses, Characterizations, and Properties of Five Interpenetrating Complexes Based on 1,4-Benzenedicarboxylic Acid and a Series of Benzimidazole-Based Linkers Crystal Growth & Design 12(11) (2012) 5439 Space group: I b c a Cell volume: 5206.3 Cell parameters: 17.834; 18.075; 16.151; 90; 90; 90; |
COD ID: 4509286 | |
CIF file | Formula: - C48 H39 Co N6 O9 - Comments: Telfer, Shane G.; Wuest, James D. Metallotectons: Comparison of Molecular Networks Built from Racemic and Enantiomerically Pure Tris(dipyrrinato)cobalt(III) Complexes Crystal Growth & Design 9(4) (2009) 1923 Space group: I b c a Cell volume: 8792 Cell parameters: 13.549; 16.35; 39.69; 90; 90; 90; |
COD ID: 4509802 | |
CIF file | Formula: - C39 H46 Cl2 Co N6 O2 - Comments: Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems Crystal Growth & Design 9(12) (2009) 5024 Space group: I b c a Cell volume: 7695 Cell parameters: 16.58; 27.108; 17.122; 90; 90; 90; |
COD ID: 4509807 | |
CIF file | Formula: - C39 H46 Cl2 Fe N6 O2 - Comments: Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems Crystal Growth & Design 9(12) (2009) 5024 Space group: I b c a Cell volume: 7657.7 Cell parameters: 16.517; 26.922; 17.221; 90; 90; 90; |
COD ID: 4509811 | |
CIF file | Formula: - C39 H46 Cd Cl2 N6 O2 - Comments: Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems Crystal Growth & Design 9(12) (2009) 5024 Space group: I b c a Cell volume: 7831 Cell parameters: 16.516; 26.779; 17.705; 90; 90; 90; |
COD ID: 4509812 | |
CIF file | Formula: - C39 H46 Cl2 N6 Ni O2 - Comments: Carlucci, Lucia; Ciani, Gianfranco; García-Ruiz, Juan Manuel; Moret, Massimo; Proserpio, Davide M.; Rizzato, Silvia Crystallization Behavior of Coordination Polymers. 1. Kinetic and Thermodynamic Features of 1,3-Bis(4-pyridyl)propane/MCl2Systems Crystal Growth & Design 9(12) (2009) 5024 Space group: I b c a Cell volume: 7526 Cell parameters: 16.484; 26.901; 16.973; 90; 90; 90; |
COD ID: 4512761 | |
CIF file | Formula: - C11 H6 Cl4 N2 O5 U - Comments: Mei, Lei; Wang, Cong-zhi; Wang, Lin; Zhao, Yu-liang; Chai, Zhi-fang; Shi, Wei-qun Halogen Bonded Three-Dimensional Uranyl‒Organic Compounds with Unprecedented Halogen‒Halogen Interactions and Structure Diversity upon Variation of Halogen Substitution Crystal Growth & Design 15(3) (2015) 1395 Space group: I b c a Cell volume: 3501 Cell parameters: 8.2621; 19.378; 21.87; 90; 90; 90; |
COD ID: 4512762 | |
CIF file | Formula: - C11 H6 Br4 N2 O5 U - Comments: Mei, Lei; Wang, Cong-zhi; Wang, Lin; Zhao, Yu-liang; Chai, Zhi-fang; Shi, Wei-qun Halogen Bonded Three-Dimensional Uranyl‒Organic Compounds with Unprecedented Halogen‒Halogen Interactions and Structure Diversity upon Variation of Halogen Substitution Crystal Growth & Design 15(3) (2015) 1395 Space group: I b c a Cell volume: 3593 Cell parameters: 8.3785; 19.437; 22.0629; 90; 90; 90; |
COD ID: 4515146 | |
CIF file | Formula: - C18.98 H15.23 Ag F3 N6 O2 S2 - Comments: Wang, Xin; Chang, Zhiduo; Jing, Xu; He, Cheng; Duan, Chunying Double-Helical Ag-S Rod-Based Porous Coordination Polymers with Double Activation: σ-Active and π-Active Functions. ACS omega 4(6) (2019) 10828-10833 Space group: I b c a Cell volume: 9896.8 Cell parameters: 8.0663; 29.9873; 40.915; 90; 90; 90; |
COD ID: 4517445 | |
CIF file | Formula: - C53 H36 Cd2 N4 O16 S2 - Comments: Chakraborty, Gouri; Das, Prasenjit; Mandal, Sanjay K. Polar Sulfone-functionalised Oxygen-rich Metal Organic Frameworks for Highly Selective CO2 Capture and Sensitive Detection of Acetylacetone at ppb Level. ACS applied materials & interfaces (2020) Space group: I b c a Cell volume: 14389.3 Cell parameters: 15.1979; 29.42; 32.182; 90; 90; 90; |
COD ID: 7004860 | |
CIF file | Formula: - C15 H35 Co F12 N2 O2 P4 - Comments: Suzuki, Takayoshi; Fujiiwara, Katsuhiro; Takagi, Hideo D.; Kashiwabara, Kazuo Preparation and characterization of mixed-ligand cobalt(III) complexes containing (3-aminopropyl)dimethylphosphine (pdmp). Conformation of the six-membered pdmp chelate ring. Dalton transactions (Cambridge, England : 2003) (issue 3) (2007) 308-319 Space group: I b c a Cell volume: 5476.2 Cell parameters: 15.177; 16.827; 21.443; 90; 90; 90; |
COD ID: 7005521 | |
CIF file | Formula: - C72 H56 P4 Pt2 - Comments: Bennett, Martin A.; Bhargava, Suresh K.; Messelhäuser, Johannes; Privér, Steven H; Welling, Lee L.; Willis, Anthony C. ortho-Metallated complexes of platinum(II) and diplatinum(I) containing the carbanions (2-diphenylphosphino)phenyl and (2-diphenylphosphino)-n-tolyl (n = 5, 6). Dalton transactions (Cambridge, England : 2003) (issue 29) (2007) 3158-3169 Space group: I b c a Cell volume: 11734.4 Cell parameters: 20.195; 23.2688; 24.9714; 90; 90; 90; |
COD ID: 7010120 | |
CIF file | Formula: - C29.19 H51.6 Cl4 Cu2 N8.6 O2.9 - Comments: Clifford, Thomas; Danby, Andrew M.; Lightfoot, Philip; Richens, David T.; Hay, Robert W. Preparation of the copper(II) complex of the binucleating hexaaza macrocycle 2,5,8,17,20,23-hexaaza[9.9]paracyclophane and its solution chemistry, hydrolytic activity and acid dissociation kinetics ‡ Journal of the Chemical Society, Dalton Transactions (issue 3) (2001) 240 Space group: I b c a Cell volume: 16012 Cell parameters: 14.971; 42.24; 25.32; 90; 90; 90; |
COD ID: 7014514 | |
CIF file | Formula: - C56 H116 K3 N8 O18 P15 Sn - Comments: Knapp, Caroline M.; Large, Joseph S.; Rees, Nicholas H.; Goicoechea, Jose M. A versatile salt-metathesis route to heteroatomic clusters derived from phosphorus and arsenic Zintl anions. Dalton transactions (Cambridge, England : 2003) 40(3) (2011) 735-745 Space group: I b c a Cell volume: 17951.9 Cell parameters: 23.848; 24.4219; 30.8233; 90; 90; 90; |
COD ID: 7014515 | |
CIF file | Formula: - C56 H116 K3 N8 O18 P15 Pb - Comments: Knapp, Caroline M.; Large, Joseph S.; Rees, Nicholas H.; Goicoechea, Jose M. A versatile salt-metathesis route to heteroatomic clusters derived from phosphorus and arsenic Zintl anions. Dalton transactions (Cambridge, England : 2003) 40(3) (2011) 735-745 Space group: I b c a Cell volume: 17813.6 Cell parameters: 23.8547; 24.2093; 30.8457; 90; 90; 90; |
COD ID: 7015826 | |
CIF file | Formula: - C42 H43 Cl6 N3 P2 Pd - Comments: Cariou, Renan; Dahcheh, Fatme; Graham, Todd W.; Stephan, Douglas W. Mononuclear and dinuclear palladium and nickel complexes of phosphinimine-based tridentate ligands. Dalton transactions (Cambridge, England : 2003) 40(18) (2011) 4918-4925 Space group: I b c a Cell volume: 8855 Cell parameters: 12.26; 20.121; 35.895; 90; 90; 90; |
COD ID: 7021044 | |
CIF file | Formula: - C45 H37 F6 N5 Ni P3 - Comments: Cariou, Renan; Graham, Todd W.; Stephan, Douglas W. Synthesis and reactivity of nickel-hydride amino-bis-phosphinimine complexes. Dalton transactions (Cambridge, England : 2003) 42(12) (2013) 4237-4239 Space group: I b c a Cell volume: 8543.9 Cell parameters: 15.7941; 18.9012; 28.6202; 90; 90; 90; |
COD ID: 7024187 | |
CIF file | Formula: - C48 H37 N6 O8 Rh - Comments: Hall, Jeremy D.; McLean, Tracey M.; Smalley, Serena J.; Waterland, Mark R.; Telfer, Shane G. Chromophoric dipyrrin complexes capable of binding to TiO2: synthesis, structure and spectroscopy. Dalton transactions (Cambridge, England : 2003) 39(2) (2010) 437-445 Space group: I b c a Cell volume: 8793.1 Cell parameters: 13.5452; 16.1898; 40.0972; 90; 90; 90; |
COD ID: 7024941 | |
CIF file | Formula: - C88 H116 Cu2 F18 N10 O10 P3 - Comments: Wenzel, Marco; Bruere, Sam R.; Knapp, Quintin W.; Tasker, Peter A.; Plieger, Paul G. Zwitterionic dicopper helicates: anion encapsulation and binding studies. Dalton transactions (Cambridge, England : 2003) 39(11) (2010) 2936-2941 Space group: I b c a Cell volume: 19371.4 Cell parameters: 20.4935; 24.4709; 38.6274; 90; 90; 90; |
COD ID: 7041398 | |
CIF file | Formula: - C40 H32 Cd5 N20 O16 - Comments: Zhang, Jian-Wei; Hu, Man-Cheng; Li, Shu-Ni; Jiang, Yu-Cheng; Zhai, Quan-Guo Microporous rod metal-organic frameworks with diverse Zn/Cd-triazolate ribbons as secondary building units for CO2 uptake and selective adsorption of hydrocarbons. Dalton transactions (Cambridge, England : 2003) 46(3) (2017) 836-844 Space group: I b c a Cell volume: 18152 Cell parameters: 17.4956; 29.4158; 35.2708; 90; 90; 90; |
COD ID: 7047749 | |
CIF file | Formula: - C46 H46 F6 Ir N6 P - Comments: Laha, Paltan; De, Umasankar; Chandra, Falguni; Dehury, Niranjan; Khullar, Sadhika; Kim, Hyung Sik; Patra, Srikanta Alkyl chain-modified cyclometalated iridium complexes as tunable anticancer and imaging agents. Dalton transactions (Cambridge, England : 2003) 47(44) (2018) 15873-15881 Space group: I b c a Cell volume: 8528 Cell parameters: 17.2258; 19.4733; 25.423; 90; 90; 90; |
COD ID: 7049361 | |
CIF file | Formula: - C80 H62 F12 O9 P4 Ru2 - Comments: Hey, Daniela A.; Fischer, Pauline J.; Baratta, Walter; Kühn, Fritz E Ru(O<sub>2</sub>CCF<sub>3</sub>)<sub>2</sub>(PPh<sub>3</sub>)<sub>2</sub> and ruthenium phosphine complexes bearing fluoroacetate ligands: synthesis, characterization and catalytic activity. Dalton transactions (Cambridge, England : 2003) 48(14) (2019) 4625-4635 Space group: I b c a Cell volume: 16017 Cell parameters: 11.996; 30.198; 44.214; 90; 90; 90; |
COD ID: 7110378 | |
CIF file | Formula: - C4 H20 Cu Mo2.5 N4 O13 P - Comments: Lu, Jianjiang; Xu, Yan; Goh, Ngoh K.; Chia, Lian S. Hydrothermal assembly and structural characterisation of one- and two-dimensional organic/inorganic hybrid materials constructed from diphosphopentamolybdate(VI) clusters and {Cu(en)}2+ complex groups Chemical Communications (issue 24) (1998) 2733 Space group: I b c a Cell volume: 6846 Cell parameters: 11.478; 39.171; 15.226; 90; 90; 90; |
COD ID: 7115689 | |
CIF file | Formula: - C50 H78 N2 Ni2 P6 - Comments: Yeong-Eun Kim; Jin Kim; Yunho Lee Formation of a nickel carbon dioxide adduct and its transformation mediated by a Lewis acid Chem.Commun. 50 (2014) 11458 Space group: I b c a Cell volume: 10524.7 Cell parameters: 18.508; 19.9088; 28.5632; 90; 90; 90; |
COD ID: 7115696 | |
CIF file | Formula: - C68 H40 Cu2 N8 O17 Zn4 - Comments: Alexandre Burgun; Rachel S. Crees; Marcus L. Cole; Christian J. Doonan; Christopher J. Sumby A 3-D diamondoid MOF catalyst based on in situ generated [Cu(L)2] N-heterocyclic carbene (NHC) linkers: hydroboration of CO2 Chem.Commun. 50 (2014) 11760 Space group: I b c a Cell volume: 20755.4 Cell parameters: 28.1305; 26.1877; 28.1745; 90; 90; 90; |
COD ID: 7118524 | |
CIF file | Formula: - C32 H31 B F4 N8 O2 Pd - Comments: Gazvoda, Martin; Virant, Miha; Pevec, Andrej; Urankar, Damijana; Bolje, Aljoša; Kočevar, Marijan; Košmrlj, Janez A mesoionic bis(Py-tzNHC) palladium(ii) complex catalyses "green" Sonogashira reaction through an unprecedented mechanism. Chemical communications (Cambridge, England) 52(8) (2016) 1571-1574 Space group: I b c a Cell volume: 12967 Cell parameters: 16.4014; 19.0245; 41.5572; 90; 90; 90; |
COD ID: 7120976 | |
CIF file | Formula: - C182 H84 Cr4 I2 Li2.04 N32 O10 - Comments: Zhou, Wen; Leznoff, Daniel B. Phthalocyanine as a redox-active platform for organometallic chemistry. Chemical communications (Cambridge, England) 54(15) (2018) 1829-1832 Space group: I b c a Cell volume: 21232 Cell parameters: 24.4994; 24.2314; 35.7646; 90; 90; 90; |
COD ID: 7202377 | |
CIF file | Formula: - C19 H26 Ag N11 O6 - Comments: Mishra, Ashutosh Kumar; Purohit, Chandra Shekhar; Verma, Sandeep Contrasting crystallographic signatures of Ag(i)- and Cu(ii)-N6,N6′- bisadenine complexes: extended vs. foldback geometries CrystEngComm 10(10) (2008) 1296 Space group: I b c a Cell volume: 5235.5 Cell parameters: 8.7535; 13.673; 43.743; 90; 90; 90; |
COD ID: 7208766 | |
CIF file | Formula: - C8 H16 Ag2 N2 O10 - Comments: Girard, Jerome; Fromm, Katharina Single crystal to single crystal polymorphic phase transition of a silver nitrate 24-crown-8 complex and its pseudo-polymorphism CrystEngComm 14(20) (2012) 6487 Space group: I b c a Cell volume: 6231.1 Cell parameters: 13.4204; 16.5076; 28.1263; 90; 90; 90; |
COD ID: 7209480 | |
CIF file | Formula: - B Ba3 O12 P3 - Comments: Bluhm, K.; Park, C.-H. Synthese und Kristallstruktur von Triblei-DiphosphatoBorat-Phosphat, eine Verbindung mit einem ((P O4)2 B P O4)6- - Anion Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 50 (1995) 1617-1622 Space group: I b c a Cell volume: 2233.89 Cell parameters: 7.0656; 14.268; 22.159; 90; 90; 90; |
COD ID: 7215784 | |
CIF file | Formula: - C9 H26 Ag4 I6 N2 O2 S2 - Comments: Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties CrystEngComm 16(24) (2014) 5280 Space group: I b c a Cell volume: 12182.7 Cell parameters: 21.0624; 23.7188; 24.3861; 90; 90; 90; |
COD ID: 7216609 | |
CIF file | Formula: - C64 H90 Mn12 O49 - Comments: Ruiz-Molina, Daniel; Gerbier, Philippe; Rumberger, Evan; Amabilino, David B.; Guzei, Ilia A.; Folting, Kirsten; Huffman, John C.; Rheingold, Arnold; Christou, George; Veciana, Jaume; Hendrickson, David N. Characterisation of nanoscopic [Mn12O12(O2CR)16(H2O)4] single-molecule magnets: physicochemical properties and LDI- and MALDI-TOF mass spectrometryLDI- and MALDI-TOF are acronyms for Laser Desorption/Ionisation and Matrix Assisted Laser Desorption/Ionisation Time-of-Flight. Journal of Materials Chemistry 12(4) (2002) 1152 Space group: I b c a Cell volume: 19030.1 Cell parameters: 21.2208; 21.2265; 42.2475; 90; 90; 90; |
COD ID: 7223390 | |
CIF file | Formula: - C28 H21 Co N4 O6 - Comments: Vrdoljak, Visnja; Pavlović, Gordana; Hrenar, Tomica; Rubčić, Mirta; Siega, Patrizia; Dreos, Renata; Cindric, Marina Cobalt(III) complexes with tridentate hydrazone ligands: protonation state and hydrogen bonds competition RSC Adv. (2015) Space group: I b c a Cell volume: 5082.4 Cell parameters: 11.5874; 18.953; 23.142; 90; 90; 90; |
COD ID: 7227364 | |
CIF file | Formula: - C16 H17 N O6 - Comments: Sarmah, Kashyap Kumar; Boro, Kaveri; Arhangelskis, Mihails; Thakuria, Ranjit Crystal structure landscape of ethenzamide: a physicochemical property study CrystEngComm 19(5) (2017) 826 Space group: I b c a Cell volume: 6191.1 Cell parameters: 14.9229; 18.9781; 21.8605; 90; 90; 90; |
COD ID: 7233433 | |
CIF file | Formula: - C17 H12 Fe N6 O4 Pt - Comments: Zhao, Jia; Huang, Hui; Liu, Ming; Wang, Jin-Hua; Liu, Kai; Li, Zhao-Yang Hofmann-like metal‒organic-framework-derived PtxFe/C/N-GC composites as efficient electrocatalysts for methanol oxidation RSC Advances 9(45) (2019) 26450 Space group: I b c a Cell volume: 9383.7 Cell parameters: 15.112; 21.1317; 29.3846; 90; 90; 90; |
COD ID: 7236959 | |
CIF file | Formula: - C34 H36 O2 - Comments: Tian, Haiyan; Wang, Pengpeng; Liu, Jing; Duan, Yuxin; Dong, Yong Qiang Construction of a tetraphenylethene derivative exhibiting high contrast and multicolored emission switching Journal of Materials Chemistry C 5(48) (2017) 12785 Space group: I b c a Cell volume: 5342.5 Cell parameters: 16.6206; 17.1087; 18.788; 90; 90; 90; |
COD ID: 7237667 | |
CIF file | Formula: - C21 H15 N2 O5 Zn - Comments: Rouhani, Farzaneh; Rafizadeh-Masuleh, Fatemeh; Morsali, Ali Selective sacrificial metal‒organic frameworks: a highly quantitative colorimetric naked-eye detector for aluminum ions in aqueous solutions Journal of Materials Chemistry A 7(31) (2019) 18634 Space group: I b c a Cell volume: 9041.2 Cell parameters: 17.635; 22.345; 22.944; 90; 90; 90; |
COD ID: 7237679 | |
CIF file | Formula: - C62 H54 Mg3 N2 O21 P2 - Comments: Reynolds, Joseph E.; Bohnsack, Alisha M.; Kristek, David J.; Gutiérrez-Alejandre, Aída; Dunning, Samuel G.; Waggoner, Nolan W.; Sikma, R. Eric; Ibarra, Ilich A.; Humphrey, Simon M. Phosphonium zwitterions for lighter and chemically-robust MOFs: highly reversible H2S capture and solvent-triggered release Journal of Materials Chemistry A 7(28) (2019) 16842 Space group: I b c a Cell volume: 17117.9 Cell parameters: 29.3448; 23.6598; 24.6552; 90; 90; 90; |
COD ID: 7241434 | |
CIF file | Formula: - C38 H31 Ag4 N18 O4.5 - Comments: Xue, Zhen-Zhen; Li, Xin-Yu; Xu, Lei; Han, Song-De; Pan, Jie; Wang, Guo-Ming Novel silver(i) cluster-based coordination polymers as efficient luminescent thermometers CrystEngComm 23(1) (2021) 56-63 Space group: I b c a Cell volume: 16698.6 Cell parameters: 21.8025; 26.2621; 29.1639; 90; 90; 90; |
COD ID: 7244660 | |
CIF file | Formula: - Eu K2 O8 P W - Comments: Terebilenko, Kateryna V.; Chornii, Vitalii P.; Zozulia, Valeriіa O.; Gural'skiy, Il'ya A.; Shova, Sergiu G.; Nedilko, Serhii G.; Slobodyanik, Mykola S. Crystal growth, layered structure and luminescence properties of K2Eu(PO4)(WO4) RSC Advances 12(15) (2022) 8901-8907 Space group: I b c a Cell volume: 1695.78 Cell parameters: 6.9856; 12.2954; 19.7434; 90; 90; 90; |
COD ID: 7246338 | |
CIF file | Formula: - C46 H24 N8 O17 Zn4 - Comments: Meng, Xin-Wei; Ding, Tao; Liu, Bin; Gong, Xue-Song; Liu, Bo; Zheng, Li-Na Highly selective C2H2 and CO2 capture based on two new ZnII-MOFs and fluorescence sensing of two doped MOFs with EuIII CrystEngComm 25(15) (2023) 2313-2320 Space group: I b c a Cell volume: 16840.6 Cell parameters: 24.2819; 24.2419; 28.6093; 90; 90; 90; |
COD ID: 7249228 | |
CIF file | Formula: - C19 H19 N5 O6 Zn - Comments: Burlak, Pavel V.; Samsonenko, Denis G.; Kovalenko, Konstantin A.; Fedin, Vladimir P. Structural polymorphism and luminescence properties of zinc(ii) and cobalt(ii) MOFs with rigid and flexible ligands CrystEngComm 26(36) (2024) 5039-5045 Space group: I b c a Cell volume: 4354.2 Cell parameters: 17.628; 15.8038; 15.6293; 90; 90; 90; |
COD ID: 7249229 | |
CIF file | Formula: - C19 H19 Co N5 O6 - Comments: Burlak, Pavel V.; Samsonenko, Denis G.; Kovalenko, Konstantin A.; Fedin, Vladimir P. Structural polymorphism and luminescence properties of zinc(ii) and cobalt(ii) MOFs with rigid and flexible ligands CrystEngComm 26(36) (2024) 5039-5045 Space group: I b c a Cell volume: 4408 Cell parameters: 17.449; 15.828; 15.959; 90; 90; 90; |
COD ID: 7702875 | |
CIF file | Formula: - C10 H14 Mo2 N6 O6 - Comments: Lysenko, Andrey B.; Senchyk, Ganna A.; Lincke, Jörg; Lässig, Daniel; Fokin, Andrey A.; Butova, Ekaterina D.; Schreiner, Peter R.; Krautscheid, Harald; Domasevitch, Konstantin V. Metal oxide-organic frameworks (MOOFs), a new series of coordination hybrids constructed from molybdenum(VI) oxide and bitopic 1,2,4-triazole linkers. Dalton transactions (Cambridge, England : 2003) 39(17) (2010) 4223-4231 Space group: I b c a Cell volume: 3054.1 Cell parameters: 12.0221; 13.0629; 19.4476; 90; 90; 90; |
COD ID: 7703628 | |
CIF file | Formula: - C56 H42 Co2 N6 O11 - Comments: Kharwar, Ajit Kumar; Konar, Sanjit Exchange coupled Co(ii) based layered and porous metal-organic frameworks: structural diversity, gas adsorption, and magnetic properties. Dalton transactions (Cambridge, England : 2003) 49(13) (2020) 4012-4021 Space group: I b c a Cell volume: 10349.3 Cell parameters: 15.2801; 23.978; 28.247; 90; 90; 90; |
COD ID: 7704073 | |
CIF file | Formula: - C6 H12 N O6 P Zn - Comments: Huang, Lijuan; Wang, Lei; Zhao, Yan; Huang, Ling; Bi, Jian; Zou, Guohong; Lin, Zhien; Gao, Daojiang Two amino acid-templated metal phosphates: surfactant-thermal synthesis, water stability, and proton conduction. Dalton transactions (Cambridge, England : 2003) 49(17) (2020) 5440-5444 Space group: I b c a Cell volume: 4064.83 Cell parameters: 8.72446; 22.3339; 20.8612; 90; 90; 90; |
COD ID: 7705378 | |
CIF file | Formula: - C42 H68 Ca N2 O6 - Comments: Hammoud, Joanna; Abou-Khalil, Fatima; Roisnel, Thierry; Dorcet, Vincent; Bour, Christophe; Gandon, Vincent; Lebœuf, David; Carpentier, Jean-François; Sarazin, Yann Alkaline-earth complexes with macrocyclic-functionalised bis(phenolate)s and bis(fluoroalkoxide)s. Dalton transactions (Cambridge, England : 2003) 49(37) (2020) 13017-13028 Space group: I b c a Cell volume: 8381.9 Cell parameters: 16.4124; 18.4546; 27.6735; 90; 90; 90; |
COD ID: 7713358 | |
CIF file | Formula: - C31 H33 Cu2 N2 O8 - Comments: Li, Xianzhen; Cao, Chen; Fan, Ziwen; Liu, Jianfa; Pham, Tony; Forrest, Katherine A.; Niu, Zheng An aliphatic MOF with a molecular sieving effect for efficient C<sub>2</sub>H<sub>2</sub>/C<sub>2</sub>H<sub>4</sub> separation. Dalton transactions (Cambridge, England : 2003) (2023) Space group: I b c a Cell volume: 6305 Cell parameters: 14.429; 15.544; 28.11; 90; 90; 90; |
COD ID: 7713957 | |
CIF file | Formula: - C48 H39 N14 O16 Zn4 - Comments: Wang, Zhi Gang; Ding, Tao; Fei, Jie The gas-selective Zn-MOF exhibits selective sensing of Fe3+ ions by doping with Tb3+ Dalton Transactions (2023) Space group: I b c a Cell volume: 17011.7 Cell parameters: 24.2346; 24.4346; 28.728; 90; 90; 90; |
COD ID: 7715927 | |
CIF file | Formula: - C20 H38 I3 N4 O5 U - Comments: Kulasekara, D. Nuwangi; Bailey, Matthew D.; Ward, Cassandra L.; Allen, Matthew J. Comparison of the structural, electrochemical, and spectroscopic properties of two cryptates of trivalent uranium. Dalton transactions (Cambridge, England : 2003) 53(20) (2024) 8657-8661 Space group: I b c a Cell volume: 6048.1 Cell parameters: 13.9235; 14.4448; 30.0718; 90; 90; 90; |
COD ID: 7715928 | |
CIF file | Formula: - C22 H46 I3 N4 O7 U - Comments: Kulasekara, D. Nuwangi; Bailey, Matthew D.; Ward, Cassandra L.; Allen, Matthew J. Comparison of the structural, electrochemical, and spectroscopic properties of two cryptates of trivalent uranium. Dalton transactions (Cambridge, England : 2003) 53(20) (2024) 8657-8661 Space group: I b c a Cell volume: 6577 Cell parameters: 14.2159; 14.8269; 31.2033; 90; 90; 90; |
COD ID: 7716201 | |
CIF file | Formula: - C8 H18 O4 Ru S6 - Comments: Chandra, Anushri; Basu, Pousali; Raha, Shreya; Dhibar, Papu; Bhattacharya, Samaresh Development of ruthenium complexes with S-donor ligands for application in synthesis, catalytic acceptorless alcohol dehydrogenation and crossed-aldol condensation. Dalton transactions (Cambridge, England : 2003) 53(25) (2024) 10675-10685 Space group: I b c a Cell volume: 3465.7 Cell parameters: 10.3358; 11.1063; 30.191; 90; 90; 90; |
COD ID: 7716206 | |
CIF file | Formula: - C10 H12 O4 Ru S6 - Comments: Chandra, Anushri; Basu, Pousali; Raha, Shreya; Dhibar, Papu; Bhattacharya, Samaresh Development of ruthenium complexes with S-donor ligands for application in synthesis, catalytic acceptorless alcohol dehydrogenation and crossed-aldol condensation. Dalton transactions (Cambridge, England : 2003) 53(25) (2024) 10675-10685 Space group: I b c a Cell volume: 3502.9 Cell parameters: 10.3525; 11.1613; 30.316; 90; 90; 90; |
COD ID: 8101390 | |
CIF file | Formula: - C Ag K O3 - Comments: Zheng, Yue-Qing; Zhou, Lin-Xia; Lin, Jian-Li; Zhang, Sun-Wei Refinement of the crystal structure of potassium catena-carbonatoargentate (I), K[Ag(CO~3~)] Zeitschrift für Kristallographie - New Crystal Structures 215(4) (2000) 467-468 Space group: I b c a Cell volume: 699.9 Cell parameters: 20.389; 5.775; 5.944; 90; 90; 90; |
COD ID: 8104133 | |
CIF file | Formula: - Bi5 I O7 - Comments: Eggenweiler, U.; Ketterer, J.; Keller, E.; Kraemer, V. The crystal structure of alpha-Bi5 O7 I Zeitschrift fuer Kristallographie (149,1979-) 216 (2001) 230-233 Space group: I b c a Cell volume: 2000.86 Cell parameters: 16.265; 5.3439; 23.02; 90; 90; 90; |
COD ID: 9000645 | |
CIF file | Formula: - Al1.64 H4 Na2.03 O14 Si4.36 - Comments: Mazzi, F.; Galli, E. Is each analcime different? ANA 4 American Mineralogist 63 (1978) 448-460 Space group: I b c a Cell volume: 2585.26 Cell parameters: 13.733; 13.729; 13.712; 90; 90; 90; |
COD ID: 9000648 | |
CIF file | Formula: - Al1.98 H4 Na2.01 O14 Si4.02 - Comments: Mazzi, F.; Galli, E. Is each analcime different? ANA 7 American Mineralogist 63 (1978) 448-460 Space group: I b c a Cell volume: 2586.58 Cell parameters: 13.727; 13.714; 13.74; 90; 90; 90; |
COD ID: 9013143 | |
CIF file | Formula: - H18 Na2 O12 Si - Comments: Pekova, I. V.; Chukanov, N. V.; Zadov, A. E.; Zubkova, N. V.; Pushcharovsky D Yu Chesnokovite, Na2[SiO2(OH)2]*8H2O, the first natural sodium orthosilicate from the Lovozero alkaline pluton, Kola Peninsula: Description and crystal structure of a new mineral species Locality: Mt. Kedykverpakhk, Lovozero alkaline pluton, Kola Peninsula, Russia Geology of Ore Deposits 49 (2007) 727-738 Space group: I b c a Cell volume: 2705.35 Cell parameters: 11.7119; 19.973; 11.5652; 90; 90; 90; |
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