Crystallography Open Database
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4335305 | CIF | C30 H43 Co N17 O17 S3 | P 3 | 23.97; 23.97; 6.6297 90; 90; 120 | 3298.8 | Pilar Amo-Ochoa; Simone S. Alexandre; Samira Hribesh; Miguel A. Galindo; Oscar Castillo; Carlos J. Gómez-García; Andrew R. Pike; José M. Soler; Andrew Houlton; Ross W. Harrington; William Clegg; Félix Zamora Correction to Coordination Chemistry of 6-Thioguanine Derivatives with Cobalt: Toward Formation of Electrical Conductive One-Dimensional Coordination Polymers Inorganic Chemistry, 2013, 52, 7306-7306 |
4335306 | CIF | C30 H39 Co N15 O13.5 S3 | P 3 | 18.815; 18.815; 6.5787 90; 90; 120 | 2016.9 | Pilar Amo-Ochoa; Simone S. Alexandre; Samira Hribesh; Miguel A. Galindo; Oscar Castillo; Carlos J. Gómez-García; Andrew R. Pike; José M. Soler; Andrew Houlton; Ross W. Harrington; William Clegg; Félix Zamora Correction to Coordination Chemistry of 6-Thioguanine Derivatives with Cobalt: Toward Formation of Electrical Conductive One-Dimensional Coordination Polymers Inorganic Chemistry, 2013, 52, 7306-7306 |
4335307 | CIF | C30 H42 Co N15 O19 S4 | P 3 | 19.225; 19.225; 6.618 90; 90; 120 | 2118.3 | Pilar Amo-Ochoa; Simone S. Alexandre; Samira Hribesh; Miguel A. Galindo; Oscar Castillo; Carlos J. Gómez-García; Andrew R. Pike; José M. Soler; Andrew Houlton; Ross W. Harrington; William Clegg; Félix Zamora Correction to Coordination Chemistry of 6-Thioguanine Derivatives with Cobalt: Toward Formation of Electrical Conductive One-Dimensional Coordination Polymers Inorganic Chemistry, 2013, 52, 7306-7306 |
4335635 | CIF | C H5 I3 N2 Pb | P 3 | 17.7914; 17.7914; 10.9016 90; 90; 120 | 2988.4 | Constantinos C. Stoumpos; Christos D. Malliakas; Mercouri G. Kanatzidis Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties Inorganic Chemistry, 2013, 52, 9019-9038 |
4335883 | CIF | C54 H29 Cl6 Cr Mn N6 O14 | P 3 | 13.7991; 13.7991; 9.0281 90; 90; 120 | 1488.77 | Matteo Atzori; Samia Benmansour; Guillermo Mínguez Espallargas; Miguel Clemente-León; Alexandre Abhervé; Patricia Gómez-Claramunt; Eugenio Coronado; Flavia Artizzu; Elisa Sessini; Paola Deplano; Angela Serpe; Maria Laura Mercuri; Carlos J. Gómez García A Family of Layered Chiral Porous Magnets Exhibiting Tunable Ordering Temperatures Inorganic Chemistry, 2013, 52, 10031-10040 |
4344212 | CIF | C12 Ir3.93357 O12 | P 3 | 13.29; 13.29; 8.981 90; 90; 120 | 1373.74 | Churchill, M.R.; Hutchinson, J.L. Crystal structure of tetrairidium dodecacarbonyl, Ir4 (C O)12. An unpleasant case of disorder Inorganic Chemistry, 1978, 17, 3528-3535 |
4344772 | CIF | C10 H11.33 Cr0.33 K Mn2 N4 O8.67 | P 3 | 13.1327; 13.1327; 7.8434 90; 90; 120 | 1171.5 | Li, Li; Nishihara, Sadafumi; Inoue, Katsuya; Kurmoo, Mohamedally Synthesis, Crystal Structure, and Magnetic Properties of a Chiral Cyanide-Bridged Bimetallic Framework K3[Mn(II)(l-asp)]6[Cr(III)(CN)6]·2H2O. Inorganic chemistry, 2015, 55, 300 |
4344773 | CIF | C10 H11.33 Cr0.33 K Mn2 N4 O8.67 | P 3 | 13.1187; 13.1187; 7.8357 90; 90; 120 | 1167.86 | Li, Li; Nishihara, Sadafumi; Inoue, Katsuya; Kurmoo, Mohamedally Synthesis, Crystal Structure, and Magnetic Properties of a Chiral Cyanide-Bridged Bimetallic Framework K3[Mn(II)(l-asp)]6[Cr(III)(CN)6]·2H2O. Inorganic chemistry, 2015, 55, 300 |
4344774 | CIF | C10 H11.33 Cr0.33 K Mn2 N4 O8.67 | P 3 | 13.106; 13.106; 7.829 90; 90; 120 | 1164.6 | Li, Li; Nishihara, Sadafumi; Inoue, Katsuya; Kurmoo, Mohamedally Synthesis, Crystal Structure, and Magnetic Properties of a Chiral Cyanide-Bridged Bimetallic Framework K3[Mn(II)(l-asp)]6[Cr(III)(CN)6]·2H2O. Inorganic chemistry, 2015, 55, 300 |
4344775 | CIF | C10 H11.33 Cr0.33 K Mn2 N4 O8.67 | P 3 | 13.0947; 13.0947; 7.8233 90; 90; 120 | 1161.75 | Li, Li; Nishihara, Sadafumi; Inoue, Katsuya; Kurmoo, Mohamedally Synthesis, Crystal Structure, and Magnetic Properties of a Chiral Cyanide-Bridged Bimetallic Framework K3[Mn(II)(l-asp)]6[Cr(III)(CN)6]·2H2O. Inorganic chemistry, 2015, 55, 300 |
4344776 | CIF | C10 H11.33 Cr0.33 K Mn2 N4 O8.67 | P 3 | 13.0899; 13.0899; 7.8212 90; 90; 120 | 1160.58 | Li, Li; Nishihara, Sadafumi; Inoue, Katsuya; Kurmoo, Mohamedally Synthesis, Crystal Structure, and Magnetic Properties of a Chiral Cyanide-Bridged Bimetallic Framework K3[Mn(II)(l-asp)]6[Cr(III)(CN)6]·2H2O. Inorganic chemistry, 2015, 55, 300 |
4344806 | CIF | C6 H18 Cl2 Co N18 O4 | P 3 | 9.4129; 9.4129; 6.1506 90; 90; 120 | 471.95 | Xu, Caixia; Zhang, Jianguo; Yin, Xin; Cheng, Zhenxuan Structural Diversity and Properties of M(II) Coordination Compounds Constructed by 3-Hydrazino-4-amino-1,2,4-triazole Dihydrochloride as Starting Material. Inorganic chemistry, 2015, 55, 322 |
4344807 | CIF | C6 H18 Cl2 Mn N18 O4 | P 3 | 9.5156; 9.5156; 6.1577 90; 90; 120 | 482.86 | Xu, Caixia; Zhang, Jianguo; Yin, Xin; Cheng, Zhenxuan Structural Diversity and Properties of M(II) Coordination Compounds Constructed by 3-Hydrazino-4-amino-1,2,4-triazole Dihydrochloride as Starting Material. Inorganic chemistry, 2015, 55, 322 |
4344809 | CIF | C6 H18 Cl2 N18 Ni O4 | P 3 | 9.3258; 9.3258; 6.0815 90; 90; 120 | 458.05 | Xu, Caixia; Zhang, Jianguo; Yin, Xin; Cheng, Zhenxuan Structural Diversity and Properties of M(II) Coordination Compounds Constructed by 3-Hydrazino-4-amino-1,2,4-triazole Dihydrochloride as Starting Material. Inorganic chemistry, 2015, 55, 322 |
4344810 | CIF | C6 H18 Cl2 N18 O4 Zn | P 3 | 9.454; 9.454; 6.1473 90; 90; 120 | 475.82 | Xu, Caixia; Zhang, Jianguo; Yin, Xin; Cheng, Zhenxuan Structural Diversity and Properties of M(II) Coordination Compounds Constructed by 3-Hydrazino-4-amino-1,2,4-triazole Dihydrochloride as Starting Material. Inorganic chemistry, 2015, 55, 322 |
4350584 | CIF | C66 H75 Cu3 F9 N9 O9 S3 | P 3 | 24.496; 24.496; 10.4042 90; 90; 120 | 5406.7 | Ohi, Hiromi; Tachi, Yoshimitsu; Itoh, Shinobu Modeling the mononuclear, dinuclear, and trinuclear copper(I) reaction centers of copper proteins using pyridylalkylamine ligands connected to 1,3,5-triethylbenzene spacer. Inorganic chemistry, 2006, 45, 10825-10835 |
4502234 | CIF | C14.67 H13 Cd N0.33 O7.33 S | P 3 | 11.6534; 11.6534; 13.7499 90; 90; 120 | 1617.09 | Lin, Jian-Di; Long, Xi-Fa; Lin, Ping; Du, Shao-Wu A Series of Cation-Templated, Polycarboxylate-Based Cd(II) or Cd(II)/Li(I) Frameworks with Second-Order Nonlinear Optical and Ferroelectric Properties Crystal Growth & Design, 2010, 10, 146 |
4514873 | CIF | C18 H28 O2 | P 3 | 15.378; 15.378; 5.9449 90; 90; 120 | 1217.5 | Yang, Junfeng; Sun, Qiao; Yoshikai, Naohiko Cobalt-Catalyzed Regio- and Diastereoselective Formal [3 + 2] Cycloaddition between Cyclopropanols and Allenes ACS Catalysis, 2019, 9, 1973 |
4516924 | CIF | C80 H120 N18 O16 S | P 3 | 27.389; 27.389; 9.7549 90; 90; 120 | 6337.3 | Portis, Bobby; Mirchi, Ali; Emami Khansari, Maryam; Pramanik, Avijit; Johnson, Corey R.; Powell, Douglas R.; Leszczynski, Jerzy; Hossain, Md Alamgir An Ideal <i>C</i><sub>3</sub>-Symmetric Sulfate Complex: Molecular Recognition of Oxoanions by <i>m</i>-Nitrophenyl- and Pentafluorophenyl-Functionalized Hexaurea Receptors. ACS omega, 2017, 2, 5840-5849 |
4519320 | CIF | C138 Nd6 O64 Yb6 | P 3 | 40.2698; 40.2698; 23.9273 90; 90; 120 | 33603.4 | Sava Gallis, Dorina F.; Butler, Kimberly S.; Pearce, Charles J.; Valdez, Nichole; Rodriguez, Mark A. Programmable Photoluminescence via Intrinsic and DNA-Fluorophore Association in a Mixed Cluster Heterometallic MOF. ACS applied materials & interfaces, 2022, 14, 10566-10576 |
7004238 | CIF | C66 H55 B N6 P3 Tl | P 3 | 38.2173; 38.2173; 10.39625 90; 90; 120 | 13150 | Kealey, Steven; Long, Nicholas J.; Miller, Philip W.; White, Andrew J. P.; Gee, Antony D. ScorpoPhos: a novel phosphine-nitrogen ligand containing a tris(pyrazolyl)borate ligand core Dalton Transactions, 2008, 2677-2679 |
7005758 | CIF | C24 H36 Co N2 O8 | P 3 | 17.44; 17.44; 7.085 90; 90; 120 | 1866.2 | Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols Dalton Transactions, 2007, 4185 |
7005763 | CIF | C24 H36 N2 Ni O8 | P 3 | 17.611; 17.611; 7.158 90; 90; 120 | 1923 | Vargas-Díaz, Gabriela; López-Sandoval, Horacio; Vázquez-Palma, Adriana B.; Flores-Alamo, Marcos; Peña-Hueso, Adrián; Sánchez-Ruíz, Sonia A.; Flores-Parra, Angelina; Contreras, Rosalinda; Barba-Behrens, Norah Stereochemistry of optically active nickel(ii) and cobalt(ii) coordination compounds derived from N-acetyl aminoalcohols Dalton Transactions, 2007, 4185 |
7008344 | CIF | C18 H56 Ga7 N13 | P 3 | 19.7013; 19.7013; 8.8318 90; 90; 120 | 2968.72 | Cowley, Andrew R.; Downs, Anthony J.; Himmel, Hans-Jorg; Marchant, Sarah; Parsons, Simon; Yeoman, Justin A. 1,1,3,3-Tetramethylguanidine-gallane, (Me2N)2CN(H).GaH3: an unusually strongly bound gallane adduct. Dalton transactions (Cambridge, England : 2003), 2005, 1591-1597 |
7011303 | CIF | C168 H161.67 Cl8 N28 O36.33 Zn4 | P 3 | 29.2594; 29.2594; 19.9252 90; 90; 120 | 14772.8 | Cheng He; Le-Yong Wang; Zhe-Ming Wang; Yuan Liu; Chun-Sheng Liao; Chun-Hua Yan Self-assembly of tetrahedral M4L6 clusters from a new rigid ligand J. Chem. Soc., Dalton Trans., 2002, 134-135 |
7011304 | CIF | C169.33 H163.33 Cl8 Cu4 N26 O37.33 | P 3 | 29.2162; 29.2162; 19.9678 90; 90; 120 | 14760.7 | Cheng He; Le-Yong Wang; Zhe-Ming Wang; Yuan Liu; Chun-Sheng Liao; Chun-Hua Yan Self-assembly of tetrahedral M4L6 clusters from a new rigid ligand J. Chem. Soc., Dalton Trans., 2002, 134-135 |
7018900 | CIF | C42 H52 Cu2 Li2 N2 O4 P2 | P 3 | 18.3517; 18.3517; 14.035 90; 90; 120 | 4093.51 | Harford, Philip J.; Haywood, Joanna; Smith, Matthew R.; Bhawal, Benjamin N.; Raithby, Paul R.; Uchiyama, Masanobu; Wheatley, Andrew E. H. Expanding the tools available for direct ortho cupration ‒ targeting lithium phosphidocuprates Dalton Transactions, 2012, 41, 6148 |
7025149 | CIF | C231 H332 F6 Fe4 N49 Ni6 O41 P | P 3 | 19.567; 19.567; 35.123 90; 90; 120 | 11646 | Shiga, Takuya; Newton, Graham N.; Mathieson, Jennifer S.; Tetsuka, Tamaki; Nihei, Masayuki; Cronin, Leroy; Oshio, Hiroki Ferromagnetically coupled chiral cyanide-bridged {Ni6Fe4} cages Dalton Transactions, 2010, 39, 4730 |
7025150 | CIF | C233 H340 F6 Fe4 N49 Ni6 O43 P | P 3 | 19.574; 19.574; 35.075 90; 90; 120 | 11638 | Shiga, Takuya; Newton, Graham N.; Mathieson, Jennifer S.; Tetsuka, Tamaki; Nihei, Masayuki; Cronin, Leroy; Oshio, Hiroki Ferromagnetically coupled chiral cyanide-bridged {Ni6Fe4} cages Dalton Transactions, 2010, 39, 4730 |
7031956 | CIF | C52 H41 N9 O9 Zn2 | P 3 | 19.106; 19.106; 11.496 90; 90; 120 | 3634.3 | Wang, Yue; Qi, Yan; Blatov, Vladislav A.; Zheng, Jimin; Li, Qun; Zhang, Chao Two new zinc(ii) coordination complexes with helix characteristics showing both interpenetration and self-catenation features: a platform for the synthesis of chiral and catenated structures assembled by length-modulated dicarboxylates. Dalton transactions (Cambridge, England : 2003), 2014, 43, 15151-15158 |
7035333 | CIF | C181.75 H183 Cl9.5 N24.5 Ni4 O32 S12 | P 3 | 26.2992; 26.2992; 19.8472 90; 90; 120 | 11888.2 | Tsang, Chui-Shan; Chen, Lingjing; Li, Lu-Wei; Yiu, Shek-Man; Lau, Tai-Chu; Kwong, Hoi-Lun Metallosupramolecular Ni2L3 and Ni4L6 complexes of bis-bidentate pyridine-containing ligands: X-ray structures and catalytic proton reduction. Dalton transactions (Cambridge, England : 2003), 2015, 44, 13087-13092 |
7043986 | CIF | C45 H53 Cd2 N7 O18 | P 3 | 17.975; 17.975; 8.8636 90; 90; 120 | 2480.2 | Cao, Li-Hui; Li, Hai-Yang; Xu, Hong; Wei, Yong-Li; Zang, Shuang-Quan Diverse dissolution-recrystallization structural transformations and sequential Förster resonance energy transfer behavior of a luminescent porous Cd-MOF Dalton Transactions, 2017, 46, 11656-11663 |
7051387 | CIF | C21 H38 Cl3.33 Fe0.33 Mg2.33 O8 | P 3 | 16.058; 16.058; 10.286 90; 90; 120 | 2297 | New Journal of Chemistry, 1999 |
7100528 | CIF | C21 H15 Co Gd N3 O15 | P 3 | 13.1879; 13.1879; 5.9291 90; 90; 120 | 893.04 | Srinivasan Natarajan; Giridhar Madras; Partha Mahata; Gopinathan Sankar A Porous Sheet 4f-3d Mixed-Metal Pyridine Dicarboxylate: Synthesis, Structure, Photophysical Properties and its Transformation to a Perovskite Oxide Chemical Communications, 2005 |
7102073 | CIF | C19.25 H18.25 Br Cl0.75 N | P 3 | 14.3387; 14.3387; 20.4479 90; 90; 120 | 3640.82 | Bond, Andrew D; Jørgensen, Wendie H; Pløger, Jane M Hydrogen-bonded cubanes and ladder fragments by analogy with the inorganic solid state. Chemical communications (Cambridge, England), 2007, 3273-3275 |
7103978 | CIF | C49 H33 N6 Ni3 O18 | P 3 | 33.5211; 33.5211; 11.3015 90; 90; 120 | 10997.7 | Prior, T. J.; Bradshaw, D.; Teat, S. J.; Rosseinsky, M. J. Designed layer assembly: a three-dimensional framework with 74% extra-framework volume by connection of infinite two-dimensional sheets Chemical Communications (Cambridge, United Kingdom), 2003, 500-501 |
7115117 | CIF | C56 H56 N12 O15 | P 3 | 16.63; 16.62; 16.01 90; 90; 120 | 3832 | Mukhopadhyay, Pritam; Bharadwaj, Parimal K.; Savitha, G.; Krishnan, Anu; Das, Puspendu K. The first D‒π‒A octupolar cryptand molecule to exhibit bulk non-linearity Chemical Communications, 2000, 1815 |
7115468 | CIF | C72 H84 N27 | P 3 | 25.2558; 25.2558; 11.0068 90; 90; 120 | 6080.1 | Marc A. Little; Samantha Y. Chong; Marc Schmidtmann; Tom Hasell; Andrew I. Cooper Guest control of structure in porous organic cages Chem.Commun., 2014, 50, 9465 |
7115469 | CIF | C72 H84 N12 | P 3 | 25.1483; 25.1483; 11.0268 90; 90; 120 | 6039.5 | Marc A. Little; Samantha Y. Chong; Marc Schmidtmann; Tom Hasell; Andrew I. Cooper Guest control of structure in porous organic cages Chem.Commun., 2014, 50, 9465 |
7115470 | CIF | C72 H84 N12 | P 3 | 25.2084; 25.2084; 11.0674 90; 90; 120 | 6090.7 | Marc A. Little; Samantha Y. Chong; Marc Schmidtmann; Tom Hasell; Andrew I. Cooper Guest control of structure in porous organic cages Chem.Commun., 2014, 50, 9465 |
7119591 | CIF | C45 H48 In N3 O6 | P 3 | 25.444; 25.444; 5.2862 90; 90; 120 | 2963.8 | Gary, Dylan C.; Petrone, Alessio; Li, Xiaosong; Cossairt, Brandi M. Investigating the role of amine in InP nanocrystal synthesis: destabilizing cluster intermediates by Z-type ligand displacement. Chemical communications (Cambridge, England), 2016, 53, 161-164 |
7204416 | CIF | C158 H158 N34 O45 | P 3 | 16.63; 16.63; 16 90; 90; 120 | 3832 | Mukhopadhyay, Pritam; Bharadwaj, Parimal K.; Savitha, G.; Krishnan, Anu; Das, Puspendu K. A new class of three dimensional D-π-A trigonal cryptand derivatives for second-order nonlinear optics Journal of Materials Chemistry, 2002, 12, 2237 |
7209765 | CIF | C3 H12 Bi Cl3 N6 S3 | P 3 | 13.593; 13.593; 7.1406 90; 90; 120 | 1142.6 | Li, Ming; Li, R. K. Crystal growth and characterization of a new polymorph of bismuth trithiourea chloride CrystEngComm, 2013, 15, 4176 |
7220293 | CIF | C21 H15 Co Dy N3 O15 | P 3 | 13.135; 13.135; 5.8794 90; 90; 120 | 878.5 | Yang, Ting-Hai; Silva, Ana Rosa; Shi, Fa-Nian Two dimensional porous 3d‒4f heterometallic coordination polymers constructed by pyridine-2,3-dicarboxylic acid CrystEngComm, 2015, 17, 3852 |
7220294 | CIF | C21 H15 Co Ho N3 O15 | P 3 | 13.0601; 13.0601; 5.8637 90; 90; 120 | 866.15 | Yang, Ting-Hai; Silva, Ana Rosa; Shi, Fa-Nian Two dimensional porous 3d‒4f heterometallic coordination polymers constructed by pyridine-2,3-dicarboxylic acid CrystEngComm, 2015, 17, 3852 |
7220295 | CIF | C21 H15 Co Er N3 O15 | P 3 | 13.0479; 13.0479; 5.8596 90; 90; 120 | 863.93 | Yang, Ting-Hai; Silva, Ana Rosa; Shi, Fa-Nian Two dimensional porous 3d‒4f heterometallic coordination polymers constructed by pyridine-2,3-dicarboxylic acid CrystEngComm, 2015, 17, 3852 |
7220296 | CIF | C21 H15 Co N3 O15 Tm | P 3 | 13.0373; 13.0373; 5.8491 90; 90; 120 | 860.98 | Yang, Ting-Hai; Silva, Ana Rosa; Shi, Fa-Nian Two dimensional porous 3d‒4f heterometallic coordination polymers constructed by pyridine-2,3-dicarboxylic acid CrystEngComm, 2015, 17, 3852 |
7222827 | CIF | Na2 O3 S2 | P 3 | 8.7287; 8.7287; 5.476 90; 90; 120 | 361.321 | von Benda, H.; von Benda, K. Zur Polymorphie des Na2 S2 O3 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986), 1979, 34, 957-968 |
7223432 | CIF | C13.33 H17.33 N O4.33 S | P 3 | 14.014; 14.014; 6.475 90; 90; 120 | 1101.3 | Balakrishnan, C.; M, Theetharappan; Natarajan, Satheesh; S, Thalamuthu; M A, Neelakantan Fluorescence response of a thiazolidine carboxylic acid derivative for the selective and nanomolar detection of Zn(II) ions: quantum chemical calculations and application in real samples RSC Adv., 2015 |
7229527 | CIF | C56.33 H63.33 N2 O8.33 | P 3 | 21.411; 21.411; 9.737 90; 90; 120 | 3865.7 | Yamasaki, Yutaro; Sekiya, Ryo; Haino, Takeharu Hexameric assembly of 5,17-di-substituted calix[4]arene in the solid state CrystEngComm, 2017 |
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