Crystallography Open Database
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Searching space group like 'P 63 2 2'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 4320485 | CIF HKL | N Ni3 | P 63 2 2 | 4.622411; 4.622411; 4.305901 90; 90; 120 | 79.6768 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320488 | CIF HKL | N Ni3 | P 63 2 2 | 4.626407; 4.626407; 4.30998 90; 90; 120 | 79.8902 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320491 | CIF HKL | N Ni3 | P 63 2 2 | 4.628995; 4.628995; 4.31263 90; 90; 120 | 80.0288 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320494 | CIF HKL | N Ni3 | P 63 2 2 | 4.631653; 4.631652; 4.31543 90; 90; 120 | 80.1727 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320497 | CIF HKL | N Ni3 | P 63 2 2 | 4.632942; 4.632942; 4.31714 90; 90; 120 | 80.2492 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320500 | CIF HKL | N Ni3 | P 63 2 2 | 4.633861; 4.633861; 4.31867 90; 90; 120 | 80.3095 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320503 | CIF HKL | N Ni3 | P 63 2 2 | 4.636302; 4.636302; 4.32179 90; 90; 120 | 80.4522 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320506 | CIF HKL | N Ni3 | P 63 2 2 | 4.634816; 4.634816; 4.32018 90; 90; 120 | 80.3706 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4320509 | CIF HKL | N Ni3 | P 63 2 2 | 4.63798; 4.63798; 4.32334 90; 90; 120 | 80.5393 | Andreas Leineweber; Herbert Jacobs; Steve Hull Ordering of Nitrogen in Nickel Nitride Ni3N Determined by Neutron Diffraction Inorganic Chemistry, 2001, 40, 5818-5822 |
| 4322502 | CIF | C84 H84 Fe Li3 O12 | P 63 2 2 | 14.8971; 14.8971; 19.2849 90; 90; 120 | 3706.4 | Ronald J. Cross; Louis J. Farrugia; Duncan R. McArthur; Robert D. Peacock; Douglas S. C. Taylor Syntheses, Crystal Structures, and CD Spectra of Simple Heterobimetallic Transition Metal Binaphtholates Inorganic Chemistry, 1999, 38, 5698-5702 |
| 4322503 | CIF | C76.8 H69.6 Cr Li3 O10.2 | P 63 2 2 | 14.85; 14.85; 19.052 90; 90; 120 | 3638.5 | Ronald J. Cross; Louis J. Farrugia; Duncan R. McArthur; Robert D. Peacock; Douglas S. C. Taylor Syntheses, Crystal Structures, and CD Spectra of Simple Heterobimetallic Transition Metal Binaphtholates Inorganic Chemistry, 1999, 38, 5698-5702 |
| 4335109 | CIF | C24 H51 Cr Ni3 O66 Sb12 | P 63 2 2 | 13.3451; 13.3451; 23.8732 90; 90; 120 | 3682.01 | Qiang Gao; Xiqu Wang; Joshua Tapp; Angela Moeller; Allan J. Jacobson Antimony Tartrate Transition-Metal-Oxo Chiral Clusters Inorganic Chemistry, 2013, 52, 6610-6616 |
| 4336944 | CIF | C42 H106 Fe7 N O68 S2 | P 63 2 2 | 16.2964; 16.2964; 18.6865 90; 90; 120 | 4297.76 | M. Menelaou; E. Vournari; V. Psycharis; C. P. Raptopoulou; A. Terzis; V. Tangoulis; Y. Sanakis; C. Mateescu; A. Salifoglou Heptanuclear Antiferromagnetic Fe(III)-d-(-)-Quinato Assemblies with an S= 3/2 Ground State-pH-Specific Synthetic Chemistry, Spectroscopic, Structural, and Magnetic Susceptibility Studies Inorganic Chemistry, 2013, 52, 13849-13860 |
| 4344304 | CIF | Cs I11 Nb6 | P 63 2 2 | 11.007; 11.007; 11.894 90; 90; 120 | 1247.95 | Imoto, H.; Corbett, J.D. A More Reduced Nb6 I8 Cluster. Synthesis and Structure of Cs Nb6 I11 and Its Hydride Cs Nb6 I11 H Inorganic Chemistry, 1980, 19, 1241-1245 |
| 4501215 | CIF | C54 H101 Fe14 K3 N2 O116 Sb12 | P 63 2 2 | 19.0892; 19.0892; 24.5573 90; 90; 120 | 7749.7 | Gao, Qiang; Wang, Xiqu; Conato, Marlon T.; Makarenko, Tatyana; Jacobson, Allan J. Microporous, Homochiral Structures Containing Iron Oxo-Clusters Supported by Antimony(III) Tartrate Scaffolds Crystal Growth & Design, 2011, 11, 4632 |
| 4518147 | CIF | C120 H96 Br9 Co4 Mn2 N24 | P 63 2 2 | 13.2935; 13.2935; 40.9 90; 90; 120 | 6259.4 | Dorval, Céline; Tricoire, Maxime; Begouin, Jeanne-Marie; Gandon, Vincent; Gosmini, Corinne Cobalt-Catalyzed C(sp2)‒CN Bond Activation: Cross-Electrophile Coupling for Biaryl Formation and Mechanistic Insight ACS Catalysis, 2020, 12819-12827 |
| 5910042 | CIF | F3 Sm | P 63 2 2 | 6.98; 6.98; 7.15 90; 90; 120 | 301.681 | Wyckoff, R. W. G. Pages 261 from the second edition of Structure of Crystals by Wyckoff R W G. Published by The Chemical Catalog Company, INC, New York in 1931 & http://www.crystallography.net/ The second edition of Structure of Crystals, 1931, 261-261 |
| 7000894 | CIF | C42 H54 Co3 F6 K N12 O12 P | P 63 2 2 | 14.575; 14.575; 13.889 90; 90; 120 | 2555.2 | Yang, Hong; Chen, Jia-Min; Sun, Jing-Jia; Yang, Shi-Ping; Yu, Jie; Tan, Hong; Li, Wei Syntheses, crystal structures and magnetic properties of three novel cobalt(ii) complexes containing imidazole derivative groups Dalton Transactions, 2009, 2540-2551 |
| 7015521 | CIF | C3 H3 Co K O6 | P 63 2 2 | 6.9978; 6.9978; 8.4687 90; 90; 120 | 359.15 | Duan, Zhiming; Wang, Zheming; Gao, Song Irreversible transformation of chiral to achiral polymorph of K[Co(HCOO)3]: synthesis, structures, and magnetic properties. Dalton transactions (Cambridge, England : 2003), 2011, 40, 4465-4473 |
| 7015522 | CIF | C3 H3 Co K O6 | P 63 2 2 | 6.993; 6.993; 8.4439 90; 90; 120 | 357.6 | Duan, Zhiming; Wang, Zheming; Gao, Song Irreversible transformation of chiral to achiral polymorph of K[Co(HCOO)3]: synthesis, structures, and magnetic properties. Dalton transactions (Cambridge, England : 2003), 2011, 40, 4465-4473 |
| 7015523 | CIF | C3 H3 Co K O6 | P 63 2 2 | 7.0124; 7.0124; 8.427 90; 90; 120 | 358.87 | Duan, Zhiming; Wang, Zheming; Gao, Song Irreversible transformation of chiral to achiral polymorph of K[Co(HCOO)3]: synthesis, structures, and magnetic properties. Dalton transactions (Cambridge, England : 2003), 2011, 40, 4465-4473 |
| 7016649 | CIF | C135 H111 Cd6 N24 Na2 O30 | P 63 2 2 | 18.643; 18.643; 24.945 90; 90; 120 | 7508 | Li, Yun-Wu; Wang, Li-Fu; He, Kun-Huan; Chen, Qiang; Bu, Xian-He A sixfold interpenetrated microporous MOF constructed from heterometallic tetranuclear cluster exhibiting selective gas adsorption. Dalton transactions (Cambridge, England : 2003), 2011, 40, 10319-10321 |
| 7039291 | CIF | B12 I In4 K3 Se12 | P 63 2 2 | 13.896; 13.896; 9.687 90; 90; 120 | 1619.9 | Guo, Sheng-Ping; Chi, Yang; Liu, Bin-Wen; Guo, Guo-Cong Synthesis, crystal structure and second-order nonlinear optical property of a novel pentanary selenide (K3I)[InB12(InSe4)3]. Dalton transactions (Cambridge, England : 2003), 2016, 45, 10459-10465 |
| 7042854 | CIF | C62.25 H45.25 Cu6 F36 N16.75 O4.75 | P 63 2 2 | 23.63; 23.63; 41.39 90; 90; 120 | 20015 | Fritzsche, Julia Christina; Grzywa, Maciej; Denysenko, Dmytro; Bon, Volodymyr; Senkovska, Irena; Kaskel, Stefan; Volkmer, Dirk CFA-4 - a fluorinated metal-organic framework with exchangeable interchannel cations Dalton Trans., 2017 |
| 7049041 | CIF | C63 H45 Cu24 Na6 O118 P | P 63 2 2 | 29.9131; 29.9131; 29.352 90; 90; 120 | 22745.3 | Meng, Wei; Ye, Hongfang; Liu, Shuai; Xu, Feng; Xu, Weijian Emergence of complex chiral coordination clusters {CuNa<sub>12</sub>} by using multiple ligands under oxidizing conditions. Dalton transactions (Cambridge, England : 2003), 2019, 48, 3204-3208 |
| 7049042 | CIF | C63 H45 Cu24 Na6 O118 P | P 63 2 2 | 30.1147; 30.1147; 29.317 90; 90; 120 | 23025.4 | Meng, Wei; Ye, Hongfang; Liu, Shuai; Xu, Feng; Xu, Weijian Emergence of complex chiral coordination clusters {CuNa<sub>12</sub>} by using multiple ligands under oxidizing conditions. Dalton transactions (Cambridge, England : 2003), 2019, 48, 3204-3208 |
| 7102226 | CIF | C194 H160 Ag5 Cl6 F30 N36 O Sb5 | P 63 2 2 | 17.791; 17.791; 37.231 90; 90; 120 | 10206 | Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Wang, Wei; Liu, Wei-Sheng; Kang, Bei-Sheng; Su, Cheng-Yong Formation of two (6,3) networks showing structural diversity, Borromean topology and conformational chirality in the same crystal Chemical Communications (Cambridge, United Kingdom), 2007, 4242-4244 |
| 7102227 | CIF | C204 H171 Ag5 F30 N24 O1.5 Sb5 | P 63 2 2 | 17.9271; 17.9271; 37.53 90; 90; 120 | 10445.5 | Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Wang, Wei; Liu, Wei-Sheng; Kang, Bei-Sheng; Su, Cheng-Yong Formation of two (6,3) networks showing structural diversity, Borromean topology and conformational chirality in the same crystal Chemical Communications (Cambridge, United Kingdom), 2007, 4242-4244 |
| 7104623 | CIF | B12 Ga3 I K3 S12 Sm | P 63 2 2 | 12.9213; 12.9213; 9.3181 90; 90; 120 | 1347.3 | Guo, Sheng-Ping; Guo, Guo-Cong; Wang, Ming-Sheng; Zou, Jian-Ping; Zeng, Hui-Yi; Cai, Li-Zhen; Huang, Jin-Shun A facile approach to hexanary chalcogenoborate featuring a 3-D chiral honeycomb-like open-framework constructed from rare-earth consolidating thiogallate-closo-dodecaborate. Chemical communications (Cambridge, England), 2009, 34, 4366-4368 |
| 7105679 | CIF | C57 H48 Cu6 O36 | P 63 2 2 | 18.5773; 18.5773; 22.6933 90; 90; 120 | 6782.6 | Wenge Qiu; Jason Perman; Lukasz Wojtas; Mohamed Eddaoudi; Michael Zaworotko Structural Diversity through Ligand Flexibility: Two Novel Metal-Organic Nets via Ligand-to-Ligand Cross-Linking of "Paddlewheels" Chem.Commun., 2010, 46, 8734 |
| 7107527 | CIF | C63 H51 Ag2 Cl2 N13 O12 | P 63 2 2 | 21.508; 21.508; 25.7514 90; 90; 120 | 10316.5 | Andrew Stephenson; Michael D. Ward A triple helix of double helicates: three hierarchical levels of self-assembly in a single structure Chem.Commun., 2012, 48, 3605 |
| 7110298 | CIF | C84 H63 Ag8 N21 O10 | P 63 2 2 | 21.79; 21.79; 12.02 90; 90; 120 | 4942.5 | Yang, Guang; Raptis, Raphael G. A robust, porous, cationic silver(i) 3,5-diphenyl-1,2,4-triazolate framework with a uninodal 49.66 netElectronic supplementary information (ESI) available: experimental details, XPRD patterns, TGA curves and IR spectra. See http://www.rsc.org/suppdata/cc/b4/b404269g/ Chemical Communications, 2004, 2058-2059 |
| 7110299 | CIF | C84 H60 Ag8 B2 F8 N18 | P 63 2 2 | 21.599; 21.599; 12.196 90; 90; 120 | 4927.4 | Yang, Guang; Raptis, Raphael G. A robust, porous, cationic silver(i) 3,5-diphenyl-1,2,4-triazolate framework with a uninodal 49.66 netElectronic supplementary information (ESI) available: experimental details, XPRD patterns, TGA curves and IR spectra. See http://www.rsc.org/suppdata/cc/b4/b404269g/ Chemical Communications, 2004, 2058-2059 |
| 7118458 | CIF | C150 H116 Cl2 Cu3 La6 N12 O56 | P 63 2 2 | 13.008; 13.008; 50.2913 90; 90; 120 | 7369.6 | Fang, Wei-Hui; Zhang, Lei; Zhang, Jian; Yang, Guo-Yu Halogen dependent symmetry change in two series of wheel cluster organic frameworks built from La18 tertiary building units. Chemical communications (Cambridge, England), 2016, 52, 1455-1457 |
| 7119274 | CIF | C18 H36 Cu4 N10 O12 | P 63 2 2 | 19.613; 19.613; 13.849 90; 90; 120 | 4613.6 | Song, Bai-Qiao; Chen, Da-Qin; Ji, Zhenguo; Tang, Junhong; Wang, Xin-Long; Zang, Hong-Ying; Su, Zhong-Min Control of bulk homochirality and proton conductivity in isostructural chiral metal-organic frameworks. Chemical communications (Cambridge, England), 2017, 53, 1892-1895 |
| 7119275 | CIF | C24 H48 Cu4 N10 O6 | P 63 2 2 | 19.603; 19.603; 13.939 90; 90; 120 | 4639 | Song, Bai-Qiao; Chen, Da-Qin; Ji, Zhenguo; Tang, Junhong; Wang, Xin-Long; Zang, Hong-Ying; Su, Zhong-Min Control of bulk homochirality and proton conductivity in isostructural chiral metal-organic frameworks. Chemical communications (Cambridge, England), 2017, 53, 1892-1895 |
| 7119276 | CIF | C24 H48 Cu4 N10 O6 | P 63 2 2 | 19.593; 19.593; 13.927 90; 90; 120 | 4630.1 | Song, Bai-Qiao; Chen, Da-Qin; Ji, Zhenguo; Tang, Junhong; Wang, Xin-Long; Zang, Hong-Ying; Su, Zhong-Min Control of bulk homochirality and proton conductivity in isostructural chiral metal-organic frameworks. Chemical communications (Cambridge, England), 2017, 53, 1892-1895 |
| 7119277 | CIF | C18 H30 Cu4 N10 O12 | P 63 2 2 | 19.6977; 19.6977; 13.8757 90; 90; 120 | 4662.5 | Song, Bai-Qiao; Chen, Da-Qin; Ji, Zhenguo; Tang, Junhong; Wang, Xin-Long; Zang, Hong-Ying; Su, Zhong-Min Control of bulk homochirality and proton conductivity in isostructural chiral metal-organic frameworks. Chemical communications (Cambridge, England), 2017, 53, 1892-1895 |
| 7128167 | CIF | C90 H54 F24 Fe2 N12 P4 | P 63 2 2 | 13.4333; 13.4333; 27.74 90; 90; 120 | 4335.1 | Siddique, Rashid G.; Arachchige, Kasun S. A.; Al-Fayaad, Hydar A; Brock, Aidan J.; Micallef, Aaron S.; Luis, Ena T.; Thoburn, John D.; McMurtrie, John C.; Clegg, Jack K. The kinetics and mechanism of interconversion within a system of [Fe<sub>2</sub>L<sub>3</sub>]<sup>4+</sup> helicates and [Fe<sub>4</sub>L<sub>6</sub>]<sup>8+</sup> cages. Chemical communications (Cambridge, England), 2021, 57, 4918-4921 |
| 7132993 | CIF | C174 H256 N6 O34 S24 | P 63 2 2 | 19.9064; 19.9064; 33.451 90; 90; 120 | 11479.6 | Shields, C. E.; Fellowes, T.; Slater, A. G.; Cooper, A. I.; Andrews, K. G.; Szczypiński, F T Exploration of the polymorphic solid-state landscape of an amide-linked organic cage using computation and automation. Chemical communications (Cambridge, England), 2024, 60, 6023-6026 |
| 7154780 | CIF | C54 H72 N6 O3 | P 63 2 2 | 18.74; 18.74; 22.056 90; 90; 120 | 6708.1 | Janiak, Agnieszka; Petryk, Małgorzata; Barbour, Leonard J.; Kwit, Marcin Readily prepared inclusion forming chiral calixsalens. Organic & biomolecular chemistry, 2015, 14, 669-673 |
| 7154781 | CIF | C54 H72 N6 O3 | P 63 2 2 | 18.64; 18.64; 22.083 90; 90; 120 | 6644.8 | Janiak, Agnieszka; Petryk, Małgorzata; Barbour, Leonard J.; Kwit, Marcin Readily prepared inclusion forming chiral calixsalens. Organic & biomolecular chemistry, 2015, 14, 669-673 |
| 7214100 | CIF | C120 H180 Co6 N6 O50 Zr6 | P 63 2 2 | 18.423; 18.423; 26.934 90; 90; 120 | 7917 | Malaestean, Iurie L.; Alıcı, Meliha Kutluca; Besson, Claire; Ellern, Arkady; Kögerler, Paul Solid-state coexistence of {Zr12} and {Zr6} zirconium oxocarboxylate clusters CrystEngComm, 2014, 16, 43 |
| 7218068 | CIF | C3 H7 N O6 Zn | P 63 2 2 | 7.309; 7.309; 8.1701 90; 90; 120 | 377.98 | Zhang, Zhiying; Li, Wei; Carpenter, Michael A.; Howard, Christopher J.; Cheetham, Anthony K. Elastic properties and acoustic dissipation associated with a disorder‒order ferroelectric transition in a metal‒organic framework CrystEngComm, 2015, 17, 370 |
| 7226831 | CIF | C3 H7 N Ni O6 | P 63 2 2 | 7.161; 7.161; 8.0474 90; 90; 120 | 357.38 | Collings, Ines E.; Bykov, Maxim; Bykova, Elena; Tucker, Matthew G.; Petitgirard, Sylvain; Hanfland, Michael; Glazyrin, Konstantin; van Smaalen, Sander; Goodwin, Andrew L.; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Structural distortions in the high-pressure polar phases of ammonium metal formates CrystEngComm, 2016, 18, 8849 |
| 7226832 | CIF | C3 H7 N Ni O6 | P 63 2 2 | 7.1208; 7.1208; 8.0513 90; 90; 120 | 353.55 | Collings, Ines E.; Bykov, Maxim; Bykova, Elena; Tucker, Matthew G.; Petitgirard, Sylvain; Hanfland, Michael; Glazyrin, Konstantin; van Smaalen, Sander; Goodwin, Andrew L.; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Structural distortions in the high-pressure polar phases of ammonium metal formates CrystEngComm, 2016, 18, 8849 |
| 7226834 | CIF | C3 H7 N Ni O6 | P 63 2 2 | 7.2864; 7.2864; 8.05248 90; 90; 120 | 370.243 | Collings, Ines E.; Bykov, Maxim; Bykova, Elena; Tucker, Matthew G.; Petitgirard, Sylvain; Hanfland, Michael; Glazyrin, Konstantin; van Smaalen, Sander; Goodwin, Andrew L.; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Structural distortions in the high-pressure polar phases of ammonium metal formates CrystEngComm, 2016, 18, 8849 |
| 7226835 | CIF | C3 H7 N Ni O6 | P 63 2 2 | 7.26097; 7.26097; 8.0811 90; 90; 120 | 368.969 | Collings, Ines E.; Bykov, Maxim; Bykova, Elena; Tucker, Matthew G.; Petitgirard, Sylvain; Hanfland, Michael; Glazyrin, Konstantin; van Smaalen, Sander; Goodwin, Andrew L.; Dubrovinsky, Leonid; Dubrovinskaia, Natalia Structural distortions in the high-pressure polar phases of ammonium metal formates CrystEngComm, 2016, 18, 8849 |
| 7228403 | CIF | C8 H18 N2 Ni2 O13 | P 63 2 2 | 8.0241; 8.0241; 7.3421 90; 90; 120 | 409.4 | Trzebiatowska, Monika; Zarychta, Bartosz; Pikul, Adam; maczka, miroslaw; Peksa, Paula; Poprawski, Ryszard Polar metal-formate frameworks templated with 1,2-diaminoethane-water assemblies showing ferromagnetic and ferroelectric properties Phys. Chem. Chem. Phys., 2017 |
| 7229682 | CIF | C6 H24 Ag2 I4 Mn N6 | P 63 2 2 | 9.1366; 9.1366; 14.4247 90; 90; 120 | 1042.81 | Chen, Xin; Yao, Zhi-Yuan; Xue, Chen; Yang, Zhu-Xi; Liu, Jian-Lan; Ren, Xiao-Ming Novel isomorphism of two hexagonal non-centrosymmetric hybrid crystals of M(en)3Ag2I4 (M = transition metal Mn2+ or main-group metal Mg2+; en = ethylenediamine) CrystEngComm, 2018, 20, 356 |
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