Crystallography Open Database
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Searching space group like 'P -6 c 2'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1001065 | CIF | Ba Ge2.5 O9 Si1.5 | P -6 c 2 | 6.667; 6.667; 9.703 90; 90; 120 | 373.5 | Goreaud, M; Choisnet, J; Deschanvres, A; Raveau, B Synthese et Evolution Structurale de Nouveaux Silicogermanates Ba Ge (Ge~3-x~ Si~x~) O~9~ de Type Benitoite et de Structure Apparentee Materials Research Bulletin, 1973, 8, 1205-1214 |
| 1001074 | CIF | Ge3 K O9 Ta | P -6 c 2 | 6.972; 6.972; 10.144 90; 90; 120 | 427 | Choisnet, J; Deschanvres, A; Raveau, B Sur de nouveaux germanates et silicates de type benitoite Journal of Solid State Chemistry, 1972, 4, 209-218 |
| 1001075 | CIF | Ge3 O9 Rb Ta | P -6 c 2 | 7.041; 7.041; 10.116 90; 90; 120 | 434.3 | Choisnet, J; Deschanvres, A; Raveau, B Sur de nouveaux qermanates et silicates de type benitoite Journal of Solid State Chemistry, 1972, 4, 209-218 |
| 1001076 | CIF | Ge3 Nb O9 Rb | P -6 c 2 | 7.038; 7.038; 10.132 90; 90; 120 | 434.6 | Choisnet, J; Deschanvres, A; Raveau, B Sur de nouveaux germanates et silicates de type benitoite Journal of Solid State Chemistry, 1972, 4, 209-218 |
| 1001077 | CIF | Ge3 O9 Ta Tl | P -6 c 2 | 7.036; 7.036; 10.124 90; 90; 120 | 434 | Choisnet, J; Deschanvres, A; Raveau, B Sur de nouveaux germanates et silicates de type benitoite Journal of Solid State Chemistry, 1972, 4, 209-218 |
| 1001078 | CIF | Ba Ge3 O9 Sn | P -6 c 2 | 6.894; 6.894; 10.233 90; 90; 120 | 421.2 | Choisnet, J; Deschanvres, A; Raveau, B Sur de nouveaux germanates et silicates de type benitoite Journal of Solid State Chemistry, 1972, 4, 209-218 |
| 1001773 | CIF | Ba O9 Si3 Sn | P -6 c 2 | 6.728; 6.728; 9.838 90; 90; 120 | 385.7 | Choisnet, J; Deschanvres, A; Raveau, B Sur de nouveaux germanates et silicates de type benitoite Journal of Solid State Chemistry, 1972, 4, 209-218 |
| 1007080 | CIF | K Mg O9 P3 | P -6 c 2 | 6.605; 6.605; 9.772 90; 90; 120 | 369.2 | Masse, R; Grenier, J C; Durif, A Trimetaphosphates mixtes N H~4~ M(II) P~3~ O~9~ isomorphes de la benitoite Bulletin de la Societe Chimique de France (Vol=Year), 1968, 1968, 1741-1742 |
| 1007257 | CIF | K Mg O9 P3 | P -6 c 2 | 6.605; 6.605; 9.772 90; 90; 120 | 369.2 | Masse, R; Grenier, J C; Averbuch-Pouchot, M T; Tranqui, D; Durif, A Etude cristallographique de trimetaphosphates hexagonaux du type M(II) N H4 (P O3)3 (M(II)= Zn, Co, Ca, Cd, Mg, Mn). Etude d'un cycle P3 O9 dans un sel de potassium isomorphe. Mg K (P O3)3 Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977), 1967, 90, 158-161 |
| 1010959 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6; 6.6; 9.71 90; 90; 120 | 366.3 | Zachariasen, W H The crystal structure of Benitoite Ba Ti Si3 O9 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1930, 74, 139-146 |
| 1510740 | CIF | B2 Be2 O7 Sr2 | P -6 c 2 | 4.683; 4.683; 15.311 90; 90; 120 | 290.792 | Wu, K.-C.; Zeng, W.-I.; Chen, C.-T.; Wu, B.-C.; Yu, L.-H.; Wang, Y.-B. Design and synthesis of an ultraviolet-transparent nonlinear optical crystal Sr2 Be2 B2 O7 Nature (London), 1995, 373, 322-324 |
| 1511281 | CIF | B O3 Tm | P -6 c 2 | 6.54; 6.54; 8.81 90; 90; 120 | 326.334 | Redman, M.J.; Santoro, R.P.; Newnham, R.E. Crystal structure of yttrium and other rare-earth borates Journal of the American Ceramic Society, 1963, 46, 253-256 |
| 1527375 | CIF | Ba5 Ga6 | P -6 c 2 | 7.771; 7.771; 14.376 90; 90; 120 | 751.835 | Fornasini, M.L.; Pani, M. Ba5 Ga6: a phase with octahedral clusters of gallium Journal of Alloys Compd., 1994, 205, 179-181 |
| 1528300 | CIF | Be3 F9 K Zn | P -6 c 2 | 6.583; 6.583; 9.623 90; 90; 120 | 361.151 | Aleonard, S.; le Fur, Y. Fluoroberyllates de structure benitoite Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977), 1966, 89, 425-427 |
| 1529157 | CIF | Br6 Cs3.91 Re6 S8 | P -6 c 2 | 9.7825; 9.7825; 18.7843 90; 90; 120 | 1556.77 | Pilet, G.; Perrin, A. New compounds in the cesium sulfobromide rhenium octahedral cluster chemistry: syntheses and crystal structures of Cs4 Re6 S8 Br6 and Cs2 Re6 S8 Br4 Solid State Sciences, 2004, 6, 109-116 |
| 1532921 | CIF | Ce N O2 Si | P -6 c 2 | 7.256; 7.256; 9.459 90; 90; 120 | 431.291 | Morgan, P.E.D.; Carroll, P.J. The crystal structures of Ce Si O2 N and La Si O2 N Journal of Materials Science, 1977, 12, 2343-2344 |
| 1532923 | CIF | La N O2 Si | P -6 c 2 | 7.31; 7.31; 9.55 90; 90; 120 | 441.946 | Morgan, P.E.D.; Carroll, P.J. The cyrstal structures of Ce Si O2 N and La Si O2 N Journal of Materials Science, 1977, 12, 2343-2344 |
| 1540898 | CIF | Nd O19 Ta7 | P -6 c 2 | 6.2229; 6.2229; 19.939 90; 90; 120 | 668.682 | Schaffrath, U.; Gruehn, R. Zum chemischen Transport von Verbindungen Des Typs Ln Ta7 O19 (Ln= La-Nd) mit einer Bemerkung zur Strukturverfeinerung von Nd Ta7 O19 Zeitschrift fuer Anorganische und Allgemeine Chemie, 1990, 588, 43-54 |
| 1561859 | CIF | Bi O19 Ta7 | P -6 c 2 | 6.219769; 6.219769; 20.02981 90; 90; 120 | 671.052 | Boltersdorf, Jonathan; Maggard, Paul A. Structural and electronic investigations of PbTa4O11 and BiTa7O19 constructed from α-U3O8 types of layers Journal of Solid State Chemistry, 2015, 229, 310-321 |
| 1562157 | CIF | Co K O9 P3 | P -6 c 2 | 6.6161; 6.6161; 9.788 90; 90; 120 | 371.05 | Ben Smida, Y.; Guesmi, A.; Georges, S.; Zid, M.F. Synthesis, crystal structure and electrical proprieties of new phosphate KCoP3O9 Journal of Solid State Chemistry, 2015, 221, 278-284 |
| 1572795 | CIF | C105 H63 Co6 N15 O25 | P -6 c 2 | 19.7252; 19.7252; 23.5747 90; 90; 120 | 7943.6 | Li, Shu-Yi; Xue, Ying-Ying; Wang, Jia-Wen; Li, Hai-Peng; Lei, Jiao; Lv, Hong-Juan; Bu, Xianhui; Zhang, Peng; Wang, Ying; Yuan, Wen-Yu; Zhai, Quan-Guo Metal-organic frameworks with two different-sized aromatic ring-confined nanotraps for benchmark natural gas upgrade. Chemical science, 2024, 15, 17547-17555 |
| 1572796 | CIF | C102 H60 Co6 N18 O25 | P -6 c 2 | 19.8699; 19.8699; 23.3404 90; 90; 120 | 7980.5 | Li, Shu-Yi; Xue, Ying-Ying; Wang, Jia-Wen; Li, Hai-Peng; Lei, Jiao; Lv, Hong-Juan; Bu, Xianhui; Zhang, Peng; Wang, Ying; Yuan, Wen-Yu; Zhai, Quan-Guo Metal-organic frameworks with two different-sized aromatic ring-confined nanotraps for benchmark natural gas upgrade. Chemical science, 2024, 15, 17547-17555 |
| 2004425 | CIF Paper | Dy O19 Ta7 | P -6 c 2 | 6.199; 6.199; 19.859 90; 90; 120 | 660.9 | Guo, G.-C.; Zhuang, J.-N.; Wang, Y.-G.; Chen, J.-T.; Zhuang, H.-H.; Huang, J.-S.; Zhang, Q.-E. Dysprosium Tantalum Oxide, DyTa~7~O~19~ Acta Crystallographica Section C, 1996, 52, 5-7 |
| 2203237 | CIF | Ca K O9 P3 | P -6 c 2 | 6.809; 6.809; 10.376 90; 90; 120 | 416.61 | Malin Sandström; Dan Boström Calcium potassium cyclo-triphosphate Acta Crystallographica, Section E, 2004, 60, i15-i17 |
| 2310096 | CIF | B O3 Yb | P -6 c 2 | 6.46; 6.46; 8.74 90; 90; 120 | 315.869 | Graf, D.L.; Bradley, W.F.; Roth, R.S. The vaterite-type A B O3 rare-earth borates Acta Crystallographica (1,1948-23,1967), 1966, 20, 283-287 |
| 4003212 | CIF | C F K O3 Zn | P -6 c 2 | 5.0182; 5.0182; 8.355 90; 90; 120 | 182.21 | Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series Chemistry of Materials, 2015, 27, 7520 |
| 4003213 | CIF | C Cd F K O3 | P -6 c 2 | 5.1349; 5.1349; 8.846 90; 90; 120 | 202 | Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series Chemistry of Materials, 2015, 27, 7520 |
| 4003214 | CIF | C Cd F O3 Rb | P -6 c 2 | 5.2109; 5.2109; 9.0645 90; 90; 120 | 213.16 | Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series Chemistry of Materials, 2015, 27, 7520 |
| 4003215 | CIF | C F O3 Rb Zn | P -6 c 2 | 5.1035; 5.1035; 8.619 90; 90; 120 | 194.41 | Yang, Guangsai; Peng, Guang; Ye, Ning; wang, Jiyang; Luo, Min; Yan, Tao; Zhou, Yuqiao Structural Modulation of Anionic Group Architectures by Cations to Optimize SHG Effects: A Facile Route to New NLO Materials in the ATCO3F (A = K, Rb; T = Zn, Cd) Series Chemistry of Materials, 2015, 27, 7520 |
| 4300164 | CIF | C15 H19 B F6 N9 P Ru | P -6 c 2 | 18.726; 18.726; 13.944 90; 90; 120 | 4235 | Eva Rüba; Walter Simanko; Kurt Mereiter; Roland Schmid; Karl Kirchner Comparing the Isoelectronic Complexes [RuTp(CH3CN)3]PF6 (Tp = Hydridotris(pyrazolyl)borate) and [RuCp(CH3CN)3]PF6. Structure and Acetonitrile Exchange Kinetics Inorganic Chemistry, 2000, 39, 382-384 |
| 4309732 | CIF | C18 H27 I7 N9 U2 | P -6 c 2 | 10.9169; 10.9169; 21.622 90; 90; 120 | 2231.6 | Alejandro E. Enriquez; Brian L. Scott; Mary P. Neu Uranium(III)/(IV) Nitrile Adducts Including UI4(N\τbCPh)4, a Synthetically Useful Uranium(IV) Complex Inorganic Chemistry, 2005, 44, 7403-7413 |
| 4328285 | CIF | C5 H2.5 Co0.5 Fe0.5 O1.5 S | P -6 c 2 | 12.137; 12.137; 13.995 90; 90; 120 | 1785.4 | Satoru Tsukada; Yusuke Shibata; Ryota Sakamoto; Tetsuya Kambe; Tomoji Ozeki; Hiroshi Nishihara Ir3Co6 and Co3Fe3 Dithiolene Cluster Complexes: Multiple Metal-Metal Bond Formation and Correlation between Structure and Internuclear Electronic Communication Inorganic Chemistry, 2012, 51, 1228-1230 |
| 4349725 | CIF | Ba9 Sn2.94 Te15 | P -6 c 2 | 10.2403; 10.2403; 20.772 90; 90; 120 | 1886.4 | Zhang, Jun; Su, Rui; Wang, Xiancheng; Li, Wenmin; Zhao, Jianfa; Deng, Zheng; Zhang, Sijia; Feng, Shaomin; Liu, Qingqing; Zhao, Huaizhou; Guan, Pengfei; Jin, Changqing Synthesis, crystal structures, and electronic properties of one dimensional Ba9Sn3(Te1−xSex)15 (x = 0‒1) Inorganic Chemistry Frontiers, 2017, 4, 1337 |
| 7001823 | CIF | C21 H64 N8 O14 | P -6 c 2 | 8.0397; 8.0397; 33.925 90; 90; 120 | 1899 | Chin, Aileen; Edgar, Mark; Harding, Charles J; McKee, Vickie; Nelson, Jane A novel trisprotonated β-dialdiminate cryptand Dalton Transactions, 2009, 6315-6326 |
| 7025296 | CIF | C84 H150 Cl6 Cu6 N24 Na2 Ni2 O54 | P -6 c 2 | 17.426; 17.426; 31.674 90; 90; 120 | 8330 | Pardo, Emilio; Dul, Marie-Claire; Lescouëzec, Rodrigue; Chamoreau, Lise-Marie; Journaux, Yves; Pasán, Jorge; Ruiz-Pérez, Catalina; Julve, Miguel; Lloret, Francesc; Ruiz-García, Rafael; Cano, Joan Variation of the ground spin state in homo- and hetero-octanuclear copper(ii) and nickel(ii) double-star complexes with a meso-helicate-type metallacryptand core Dalton Transactions, 2010, 39, 4786 |
| 7102578 | CIF | C84 H174 Cl6 Cu8 N24 Na2 O54 | P -6 c 2 | 17.4169; 17.4169; 31.739 90; 90; 120 | 8338.1 | Pardo, Emilio; Bernot, Kevin; Julve, Miguel; Lloret, Francesc; Cano, Joan; Ruiz-García, Rafael; Pasán, Jorge; Ruiz-Pérez, Catalina; Ottenwaelder, Xavier; Journaux, Yves Self-assembly and magnetic properties of a double-propeller octanuclear copper(II) complex with a meso-helicate-type metallacryptand core. Chemical communications (Cambridge, England), 2004, 920-921 |
| 7109720 | CIF | C42 H36 Cl7 Cr3 Cu3 N6 O16 | P -6 c 2 | 13.469; 13.469; 27.51 90; 90; 120 | 4322 | Sameh K. Elsaidi; Mona H. Mohamed; Lukasz Wojtas; Amy J. Cairns; Mohamed Eddaoudi; Michael J. Zaworotko Two-step crystal engineering of porous nets from [Cr/3(mu/3-O)(RCO/2)6] and [Cu/3(mu/3-Cl)(RNH2)/6Cl/6] molecular building blocks Chem.Commun., 2013, 49, 8154 |
| 7206886 | CIF | Ba Hf O9 Si3 | P -6 c 2 | 6.77318; 6.77318; 10.00456 90; 90; 120 | 397.479 | Wang, De-Yin; Wu, Yun-Chen; Chen, Teng-Ming Synthesis, crystal structure, and photoluminescence of a novel blue-green emitting phosphor: BaHfSi3O9:Eu2+ Journal of Materials Chemistry, 2011, 21, 18261 |
| 7237230 | CIF | C96 H54 Co6 N24 O25 | P -6 c 2 | 19.2411; 19.2411; 23.8936 90; 90; 120 | 7660.8 | Xue, Ying-Ying; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng; Zhai, Quan-Guo Quest for 9-connected robust metal‒organic framework platforms based on [M3(O/OH)(COO)6(pyridine)3] clusters as excellent gas separation and asymmetric supercapacitor materials Journal of Materials Chemistry A, 2019, 7, 4640 |
| 9007962 | CIF | Ca K O9 P3 | P -6 c 2 | 6.809; 6.809; 10.376 90; 90; 120 | 416.608 | Sandstrom, M.; Bostrom, D. Calcium potassium cyclo-triphosphate Acta Crystallographica, Section E, 2004, 60, i15-i17 |
| 9008010 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6; 6.6; 9.74 90; 90; 120 | 367.432 | Zachariasen, W. H. The crystal structure of benitoite, BaTiSi3O9 Zeitschrift fur Kristallographie, 1930, 74, 139-146 |
| 9008168 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.641; 6.641; 9.759 90; 90; 120 | 372.737 | Fisher, V. K. Verfeinerung der kristallstruktur von benitoit BaTi[Si3O9] Sample: Dallas Gem Mine, San Benito, Ca Zeitschrift fur Kristallographie, 1969, 129, 222-243 |
| 9009330 | CIF | Ba O9 Si3 Sn0.77 Ti0.23 | P -6 c 2 | 6.7037; 6.7037; 9.824 90; 90; 120 | 382.339 | Hawthorne, F. C. The crystal chemistry of the benitoite group minerals and structural relations in (Si3O9) ring structures Sample: "occurs in small fractures and as scattered grains in recrystallized siliceous limestone at Santa Cruz, Ca" Neues Jahrbuch fur Mineralogie, Monatshefte, 1987, 1987, 16-30 |
| 9009331 | CIF | Ba O9 Si3 Ti0.03 Zr0.97 | P -6 c 2 | 6.742; 6.742; 9.93 90; 90; 120 | 390.893 | Hawthorne, F. C. The crystal chemistry of the benitoite group minerals and structural relations in (Si3O9) ring structures Sample: "late-stage interstitial mineral in aegirine-riebeckite granite", Rockall Island, Scotland Neues Jahrbuch fur Mineralogie, Monatshefte, 1987, 1987, 16-30 |
| 9014388 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.643; 6.643; 9.766 90; 90; 120 | 373.229 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 0.0001 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 9014925 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6094; 6.6094; 9.7239 90; 90; 120 | 367.871 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 1.12 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 9015046 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.6031; 6.6031; 9.71 90; 90; 120 | 366.645 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 2.14 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 9015194 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5518; 6.5518; 9.6503 90; 90; 120 | 358.751 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 4.28 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 9016221 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5689; 6.5689; 9.6804 90; 90; 120 | 361.751 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 3.56 GPa American Mineralogist, 2012, 97, 1749-1763 |
| 9016710 | CIF | Ba O9 Si3 Ti | P -6 c 2 | 6.5605; 6.5605; 9.6574 90; 90; 120 | 359.969 | Hejny, C.; Miletich, R.; Jasser, A.; Schouwink, P.; Crichton, W.; Kahlenberg, V. Second-order P6c2-P31c transition and structural crystallography of the cyclosilicate benitoite, BaTiSi3O9, at high pressure Note: P = 4.01 GPa American Mineralogist, 2012, 97, 1749-1763 |
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