Crystallography Open Database
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Searching space group like 'P 3'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 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 |
| 7229530 | CIF | C56.67 H63 N2.33 O8 | P 3 | 21.4358; 21.4358; 9.708 90; 90; 120 | 3863.1 | Yamasaki, Yutaro; Sekiya, Ryo; Haino, Takeharu Hexameric assembly of 5,17-di-substituted calix[4]arene in the solid state CrystEngComm, 2017 |
| 7229531 | CIF | C56.67 H64 N2 O8.33 | P 3 | 21.4114; 21.4114; 9.799 90; 90; 120 | 3890.5 | Yamasaki, Yutaro; Sekiya, Ryo; Haino, Takeharu Hexameric assembly of 5,17-di-substituted calix[4]arene in the solid state CrystEngComm, 2017 |
| 7229532 | CIF | C56 H62 N2 O8 | P 3 | 21.43; 21.43; 9.6863 90; 90; 120 | 3852.4 | Yamasaki, Yutaro; Sekiya, Ryo; Haino, Takeharu Hexameric assembly of 5,17-di-substituted calix[4]arene in the solid state CrystEngComm, 2017 |
| 7233401 | CIF | C90 H70 Gd2 N18 O25 | P 3 | 19.109; 19.109; 8.6482 90; 90; 120 | 2734.8 | Bhattacharya, Sudeshna; Bala, Sukhen; Mondal, Raju Ln-MOFs using a compartmental ligand with a unique combination of hard‒soft terminals and their magnetic, gas adsorption and luminescence properties CrystEngComm, 2019, 21, 5665 |
| 7233402 | CIF | C90 H90 Dy2 N18 O28 | P 3 | 19.1877; 19.1877; 8.5095 90; 90; 120 | 2713.2 | Bhattacharya, Sudeshna; Bala, Sukhen; Mondal, Raju Ln-MOFs using a compartmental ligand with a unique combination of hard‒soft terminals and their magnetic, gas adsorption and luminescence properties CrystEngComm, 2019, 21, 5665 |
| 7234364 | CIF | C188 H180 B8 F32 Fe4 N52 | P 3 | 31.59; 31.59; 18.32 90; 90; 120 | 15833 | Li Li; Naoto Saigo; Yingjie Zhang; Daniel J. Fanna; Nicholas D. Shepherd; Jack K. Clegg; Rongkun Zheng; Shinya Hayami; Leonard F. Lindoy; Janice R. Aldrich-Wright; Chun-Guang Li; Jason K. Reynolds; David G. Harman; Feng Li A large spin-crossover [Fe4L4]8+ tetrahedral cage Journal of Materials Chemistry C, 2015, 3, 7878-7882 |
| 7237154 | CIF | C48 H36 Cu4 N12 O12 | P 3 | 26.0992; 26.0992; 9.2584 90; 90; 120 | 5461.61 | Li, Ziyin; Ye, Yingxiang; Yao, Zizhu; Guo, Junzhi; Lin, Quanjie; Zhang, Jindan; Zhang, Zhangjing; Wei, Fangfang; Xiang, Shengchang An antiferromagnetic metalloring pyrazolate (Pz) framework with [Cu12(μ2-OH)12(Pz)12] nodes for separation of C2H2/CH4 mixture Journal of Materials Chemistry A, 2018, 6, 19681 |
| 7237560 | CIF | C264 H289 Mn6 N42 O43 P Ru6 | P 3 | 26.526; 26.526; 11.595 90; 90; 120 | 7065.5 | Zhang, Daopeng; Cano, Joan; Lan, Wenlong; Liu, Hui; Sun, Fenggang; Dong, Yunhui; Zhou, Zhen; Yang, Lu; Liu, Qingyun; Jiang, Jianzhuang Unconventional dihydrogen-bond interaction induced cyanide-bridged chiral nano-sized magnetic molecular wheel: synthesis, crystal structure and systematic theoretical magnetism investigation Journal of Materials Chemistry C, 2019, 7, 3623 |
| 7707868 | CIF | C44 H49 Fe N5 O3.5 P3 | P 3 | 17.252; 17.252; 8.2626 90; 90; 120 | 2129.74 | Sun, Chen; Oswald, Victoria F.; Hill, Ethan A.; Ziller, Joseph W.; Borovik, A. S. Investigation of iron-ammine and amido complexes within a C<sub>3</sub>-symmetrical phosphinic amido tripodal ligand. Dalton transactions (Cambridge, England : 2003), 2021, 50, 11197-11205 |
| 7713468 | CIF | C80.33 H76.67 Cl7.67 Co2 N15 | P 3 | 24.4385; 24.4385; 11.3928 90; 90; 120 | 5892.6 | Mikhailenko, Maxim V.; Ivanov, Vladislav V.; Shestakov, Alexander F.; Kuzmin, Alexey V.; Khasanov, Salavat S.; Otsuka, Akihiro; Yamochi, Hideki; Kitagawa, Hiroshi; Konarev, Dmitri V. Magnetic behavior and ground spin states for coordination {L.[M(II)(Hal)2]3}(3-) assemblies (Hal = Cl or I) of radical trianion hexacyanohexaazatriphenylenes (L) with three coordinated high-spin Fe(II) (S = 2) or Co(II) (S = 3/2) centers Dalton Transactions, 2023 |
| 7713919 | CIF | B2 O17 P3 Pu | P 3 | 7.8764; 7.8764; 5.5355 90; 90; 120 | 297.4 | Sigmon, Ginger; DiBlasi, Nicole Ann; Hixon, Amy The Crystal Chemistry of Plutonium(IV) Borophosphate Dalton Transactions, 2023 |
| 7714594 | CIF | C102 H108 Cl13 Fe5 N12 | P 3 | 12.444; 12.444; 20.0425 90; 90; 120 | 2687.8 | Yousuf, Nighat; Ma, Yanping; Mahmood, Qaiser; Zhang, Wenjuan; Wang, Yizhou; Saeed, Hassan; Sun, Wen-Hua Enhancing isoprene polymerization with high activity and adjustable monomer enchainment using cyclooctyl-fused iminopyridine iron precatalysts. Dalton transactions (Cambridge, England : 2003), 2024, 53, 753-764 |
| 8101262 | CIF | B2 Cr4 O24 P6 | P 3 | 7.95419; 7.95419; 7.3613 90; 90; 120 | 403.345 | Mi, Jin-Xiao; Zhao, Jing-Tai; Mao, Shao-Yu; Huang, Ya-Xi; Engelhardt, Holger; Kniep, Rüdiger Crystal structure of dichromium monoborotriphosphate, Cr~2~[BP~3~O~12~] Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 201-202 |
| 9000916 | CIF | B6 Ba F2 O24 Si3 Y6 | P 3 | 10.67; 10.67; 4.68 90; 90; 120 | 461.429 | Shen, J.; Moore, P. B. Crystal structure of cappelenite, Ba(Y,RE)6[Si3B6O24]F2: a silicoborate sheet structure American Mineralogist, 1984, 69, 190-195 |
| 9001785 | CIF | Ni O18 Sb2 | P 3 | 16.06; 16.06; 9.792 90; 90; 120 | 2187.22 | Bonazzi, P.; Mazzi, F. Bottinoite, Ni(H2O)6[Sb(OH)6]2: Crystal structure, twinning and hydrogen-bond model Sample: BS2, synthetic Note: U(1,2) for Sb1 and Sb3 changed to match symmetry constraints. American Mineralogist, 1996, 81, 1494-1500 |
| 9001786 | CIF | Ni O18 Sb2 | P 3 | 16.045; 16.045; 9.784 90; 90; 120 | 2181.36 | Bonazzi, P.; Mazzi, F. Bottinoite, Ni(H2O)6[Sb(OH)6]2: Crystal structure, twinning and hydrogen-bond model Sample: BN1, natural Locality: Bottino mine, Apuan Alps, Italy Note: U(1,2) for Sb5 and Sb6 changed to match symmetry constraints. American Mineralogist, 1996, 81, 1494-1500 |
| 9001890 | CIF | H12 O23 S Si Zn8 | P 3 | 8.319; 8.319; 7.377 90; 90; 120 | 442.133 | Hoffmann, C.; Armbruster, T.; Giester, G. The acentric structure (P3) of bechererite, Zn7Cu(OH)13[SiO(OH)3SO4] Note U(1,2) for Zn2, Zn21, and O1 changed to match symmetry constraints. American Mineralogist, 1997, 82, 1014-1018 |
| 9002181 | CIF | Ba O9 Si4 | P 3 | 11.2469; 11.2469; 4.4851 90; 90; 120 | 491.325 | Hazen, R. M.; Yang, H.; Finger, L. W.; Fursenko, B. A. Crystal chemistry of high-pressure BaSi4O9 in the trigonal (P3) barium tetragermanate structure American Mineralogist, 1999, 84, 987-989 |
| 9002342 | CIF | H24 Mg O18 Sb2 | P 3 | 16.119; 16.119; 9.868 90; 90; 120 | 2220.42 | Friedrich, A.; Wildner, M.; Tillmanns, E.; Merz, P. L. Crystal chemistry of the new mineral brandholzite, Mg(H2O)6[Sb(OH)6]2, and of the synthetic analogues M(H2O)6[Sb(OH)6]2 (Me=Mg,Co) American Mineralogist, 2000, 85, 593-599 |
| 9002343 | CIF | Co O18 Sb2 | P 3 | 16.105; 16.105; 9.851 90; 90; 120 | 2212.75 | Friedrich, A.; Wildner, M.; Tillmanns, E.; Merz, P. L. Crystal chemistry of the new mineral brandholzite, Mg(H2O)6[Sb(OH)6]2, and of the synthetic analogues M(H2O)6[Sb(OH)6]2 (Me=Mg,Co) American Mineralogist, 2000, 85, 593-599 |
| 9002701 | CIF | H9 O14 Sr1.27 U3 | P 3 | 7.02; 7.02; 6.992 90; 90; 120 | 298.405 | Burns, P. C.; Li, Y. The structures of becquerelite and Sr-exchanged becquerelite put occ in tables Sample: Sr-exchanged becquerelite American Mineralogist, 2002, 87, 550-557 |
| 9002900 | CIF | Co O18 Sb2 | P 3 | 16.105; 16.105; 9.851 90; 90; 120 | 2212.75 | Friedrich, A.; Mazzi, F.; Wildner, M.; Tillmanns, E. Isotypism of Co(H2O)6[Sb(OH)6]2 with brandholzite and bottinoite American Mineralogist, 2003, 88, 462-463 |
| 9003815 | CIF | C2 O12 Pb4 S | P 3 | 9.077; 9.077; 11.611 90; 90; 120 | 828.486 | Bindi, L.; Menchetti, S. Structural changes accompanying the phase transformation between leadhillite and susannite: a structural study by means of in situ high-temperature single- crystal X-ray diffraction Sample: Chah Mileh Mine, Anarak District, Esfahan Province, Iran Sample: T = 82C American Mineralogist, 2005, 90, 1641-1647 |
| 9004255 | CIF | Al4 H O14 Ta3 | P 3 | 7.381; 7.381; 4.516 90; 90; 120 | 213.066 | Ercit, T. S.; Cerny, P.; Hawthorne, F. C. The crystal chemistry of simpsonite The Canadian Mineralogist, 1992, 30, 663-671 |
| 9004969 | CIF | Ca0.75 H11.17 O32.46 Ti3 U5.31 | P 3 | 10.824; 10.824; 7.549 90; 90; 120 | 765.942 | Sokolova, E.; Hawthorne, F. C.; Belakovskiy, D. I.; Pautov, L. A. The OD (order-disorder) structure of holfertite, a hydrated uranyl titanate mineral from Searle Canyon, Thomas Range, Utah, USA The Canadian Mineralogist, 2005, 43, 1545-1552 |
| 9005394 | CIF | C2 H2 O12 Pb4 S | P 3 | 9.0718; 9.0718; 11.57 90; 90; 120 | 824.614 | Steele, I. M.; Pluth, J. J.; Livingstone, A. Crystal structure of susannite, Pb4SO4(CO3)2(OH)2: a trimorph with macphersonite and leadhillite European Journal of Mineralogy, 1999, 11, 493-499 |
| 9009259 | CIF | B Be2 H3 O5 | P 3 | 4.434; 4.434; 5.334 90; 90; 120 | 90.819 | Giuseppetti, G.; Mazzi, F.; Tadini, C.; Larsen, A. O.; Asheim, A.; Raade, G. Berborite polytypes Locality: Saga I larvikite quarry, Morje, Porgrunn, Tvelan District, Norway Sample: 1T polytype Note: anisoU's from ICSD Neues Jahrbuch fur Mineralogie, Abhandlungen, 1990, 162, 101-116 |
| 9009329 | CIF | H3 Mn3 O7 Si V0.5 | P 3 | 8.1518; 8.1518; 4.8091 90; 90; 120 | 276.759 | Pertlik, F. The crystal structure of franciscanite, Mn3(Vx_1-x)(SiO4)(O,OH)3,(x ~ 0.5) California, USA Neues Jahrbuch fur Mineralogie, Monatshefte, 1986, 1986, 493-499 |
| 9009505 | CIF | Cl2 Cu6.01 O10 V2 | P 3 | 6.375; 6.375; 8.399 90; 90; 120 | 295.61 | Starova, G. L.; Krivovichev, S. V.; Fundamensky, V. S.; Filatov, S. K. The crystal structure of averievite, Cu5O2(VO4)2*nMX: comparison with related compounds Note: Coordinates for O6 added to the dataset by Krivovichev Aug 2005 Mineralogical Magazine, 1997, 61, 441-446 |
| 9009983 | CIF | Ni Ti0.875 | P 3 | 4.2579; 4.2579; 5.2149 90; 90; 120 | 81.878 | Sitepu, H.; Wright, J. P.; Hansen, T.; Chateigner, D.; Brokmeier, H. G.; Ritter, C.; Ohba, T. Combined synchrotron and neutron structural refinement of R-phase in Ti50.75Ni47.75Fe1.50 shape memory alloy Materials Science Forum, 2005, 495, 255-260 |
| 9011952 | CIF | Cu0.3 Fe6.6 H36 K2 Na6 O68 S12 Zn0.1 | P 3 | 9.575; 9.575; 18.17 90; 90; 120 | 1442.66 | Giacovazzo, C.; Scordari, F.; Todisco, A.; Menchetti, S. Crystal structure model for metavoltine from Sierra Gorda Tschermaks Mineralogische und Petrographische Mitteilungen, 1976, 23, 155-166 |
| 9012620 | CIF | Ca6 H6 O13 Si2 | P 3 | 10.035; 10.035; 7.499 90; 90; 120 | 653.986 | Yamnova, N. A.; Sarp, K.; Egorov-Tismenko Y K; Pushcharovskii, D. Y. Crystal structure of jaffeite Crystallography Reports, 1993, 38, 464-467 |
| 9012761 | CIF | Fe0.48 H0.56 O | P 3 | 2.955; 2.955; 9.37 90; 90; 120 | 70.857 | Jansen, E.; Kyek, A.; Schafer, W.; Schwertmann, U. The structure of six-line ferrihydrite Sample: defective refinement Applied Physics A, 2002, 74, S1004-S1006 |
| 9012775 | CIF | Ba0.94 Ca0.04 Ce0.18 K0.06 Na2.12 O8 P2 Sr0.66 | P 3 | 5.541; 5.541; 7.02 90; 90; 120 | 186.657 | Pekov, I. V.; Chukanov, N. V.; Kulikova, I. M.; Zubkova, N. V.; Krotova, O. D.; Sorokina, N. I.; Pushcharovsky, D. Y. New mineral bario-olgite, Ba(Na,Sr,REE)2Na[PO4]2 and its crystal structure Zapiski Vserossijskogo Mineralogicheskogo Obshchestva, 2004, 133, 41-49 |
| 9013194 | CIF | Br Cl2 Hg12 O6 Sb | P 3 | 13.56; 13.56; 10.004 90; 90; 120 | 1593.03 | Pervukhina, N. V.; Borisov, S. V.; Magarill, S. A.; Naumov, D. Y.; Vasilev, V. I. The crystal structure of kelyanite (Hg2)6(SbO6)BrCl2 American Mineralogist, 2008, 93, 1666-1669 |
| 9014915 | CIF | Al90 Ca36 Cl3 H12 K9 Na21 O470 S26 Si90 | P 3 | 12.913; 12.913; 79.605 90; 90; 120 | 11495.4 | Rastsvetaeva, R. K.; Chukanov, N. V. Model of the crystal structure of biachellaite as a new 30-layer member of the cancrinite group Crystallography Reports, 2008, 53, 981-988 |
| 9016540 | CIF | H18 Na2.76 Nb3 O26 Si4 | P 3 | 9.937; 9.937; 7.004 90; 90; 120 | 598.946 | Haring, M. M. M.; McDonald, A. M.; Cooper, M. A.; Poirier, G. A. Laurentianite, [NbO(H2O)]3(Si2O7)2[Na(H2O)2]3, a new mineral from Mont Saint-Hilaire, Quebec: description, crystal-structure determination and paragenesis The Canadian Mineralogist, 2012, 50, 1265-1280 |
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