Crystallography Open Database
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Searching space group like 'P a -3'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1100901 | CIF | C48 H93 Ge K N3 P3 Si6 | P a -3 | 23.4873; 23.4873; 23.4873 90; 90; 90 | 12956.8 | Izod, Keith; McFarlane, William; Allen, Ben; Clegg, William; Harrington, Ross W. An Intramolecularly Base-Stabilized Diphosphagermylene and Two Unusual Germanium(II) Ate Complexes: A Structural, NMR, and DFT Study Organometallics, 2005, 24, 2157-2167 |
| 1505078 | CIF | C H11 B10 P | P a -3 | 9.7418; 9.7418; 9.7418 90; 90; 90 | 924.5 | Balaz, Snjezana; Caruso, A. N.; Platt, N. P.; Dimov, D. I.; Boag, N. M.; Brand, J. I.; Losovyj, Ya B.; Dowben, P. A. The influence of the molecular dipole on the electronic structure of isomeric icosahedral dicarbadodecaborane and phosphacarbadodecaborane molecular films. The journal of physical chemistry. B, 2007, 111, 7009-7016 |
| 1505734 | CIF | C12 H12 Cr | P a -3 | 9.5714; 9.5714; 9.5714 90; 90; 90 | 876.85 | Lyssenko, Konstantin A.; Korlyukov, Alexander A.; Golovanov, Denis G.; Ketkov, Sergey Yu; Antipin, Mikhail Yu Estimation of the barrier to rotation of benzene in the (eta 6-C6H6)2Cr crystal via topological analysis of the electron density distribution function. The journal of physical chemistry. A, 2006, 110, 6545-6551 |
| 1507675 | CIF | C71.63 H53.5 Cl1.25 O4.38 | P a -3 | 21.814; 21.814; 21.814 90; 90; 90 | 10380.2 | Yamaguchi, Ryuichi; Hiroto, Satoru; Shinokubo, Hiroshi Synthesis of oxygen-substituted hexa-peri-hexabenzocoronenes through Ir-catalyzed direct borylation. Organic letters, 2012, 14, 2472-2475 |
| 1507796 | CIF | C24 H12 N12 O25 Zn6 | P a -3 | 20.123; 20.123; 20.123 90; 90; 90 | 8148.5 | Tranchemontagne, David J.; Park, Kyo Sung; Furukawa, Hiroyasu; Eckert, Juergen; Knobler, Carolyn B.; Yaghi, Omar M. Hydrogen Storage in New Metal‒Organic Frameworks The Journal of Physical Chemistry C, 2012, 116, 13143 |
| 1509644 | CIF | Ag2 B12 Cl12 | P a -3 | 12.3832; 12.3832; 12.3832 90; 90; 90 | 1898.89 | Schleid, T.; Tiritiris, I. The crystal structure of solvent-free silver dodecachloro-closo-dodecaborate Ag2 (B12 Cl12) from aqueous solution Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 581-583 |
| 1510289 | CIF | Au Sb2 | P a -3 | 6.66; 6.66; 6.66 90; 90; 90 | 295.408 | Westgren, A.; Almin, A.; Nial, O. Roentgenanalyse der Systeme Au-Sb und Ag-Sn Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie, 1931, 14, 81-90 |
| 1510797 | CIF | B2 O4 Sr | P a -3 | 9.2123; 9.2123; 9.2123 90; 90; 90 | 781.815 | Angel, R.J.; Ross, N.L. Crystal structure of high pressure SrB2O4(IV) Journal of Solid State Chemistry, 1991, 90, 27-30 |
| 1510884 | CIF | B2 Ca S4 | P a -3 | 11.21; 11.21; 11.21 90; 90; 90 | 1408.69 | Endo, T.; Takeda, T.; Sasaki, T.; Takizawa, H. High-pressure synthesis of a new calcium thioborate, Ca B2 S4 Materials Research Bulletin, 2003, 38, 33-39 |
| 1511041 | CIF | B Cl11.34 I2.66 Sr0.5 Zr6 | P a -3 | 13.262; 13.262; 13.262 90; 90; 90 | 2332.53 | Koeckerling, M. New boron-centered mixed-halide zirconium cluster phases with a cubic structure: Na Zr6 Cl(12-2x) I(2+x) B(x<=6) and A(II)0.5 Zr6 (Cl, I)14 B (A(II)=Ca, Sr, Ba) Zeitschrift fuer Anorganische und Allgemeine Chemie, 1999, 625, 24-30 |
| 1513866 | CIF | C45 H51 Cr Fe I N3 P3 | P a -3 | 20.6666; 20.6666; 20.6666 90; 90; 90 | 8826.9 | Kuppuswamy, Subramaniam; Bezpalko, Mark W.; Powers, Tamara M.; Wilding, Matthew J. T.; Brozek, Carl K.; Foxman, Bruce M.; Thomas, Christine M. A series of C3-symmetric heterobimetallic Cr‒M (M = Fe, Co and Cu) complexes Chemical Science, 2014, 5, 1617 |
| 1513867 | CIF | C45 H51 Co Cr I N3 P3 | P a -3 | 20.6768; 20.6768; 20.6768 90; 90; 90 | 8839.95 | Kuppuswamy, Subramaniam; Bezpalko, Mark W.; Powers, Tamara M.; Wilding, Matthew J. T.; Brozek, Carl K.; Foxman, Bruce M.; Thomas, Christine M. A series of C3-symmetric heterobimetallic Cr‒M (M = Fe, Co and Cu) complexes Chemical Science, 2014, 5, 1617 |
| 1515631 | CIF | C132 H180 Cl12 Co8 N72 O4 | P a -3 | 25.1026; 25.1026; 25.1026 90; 90; 90 | 15818.2 | Alkordi, Mohamed H.; Belof, Jonathan L.; Rivera, Edwin; Wojtas, Lukasz; Eddaoudi, Mohamed Insight into the construction of metal‒organic polyhedra: metal‒organic cubes as a case study Chemical Science, 2011, 2, 1695 |
| 1517731 | CIF | Nb O7 P2.02 | P a -3 | 8.083; 8.083; 8.083 90; 90; 90 | 528.1 | Fukuoka, H.; Imoto, H.; Saito, T. Preparation of cubic niobium pyrophosphate containing Nb(IV) and topotactic extraction of phosphorus atoms Journal of Solid State Chemistry, 1995, 119, 98-106 |
| 1517732 | CIF | Nb O7 P1.92 | P a -3 | 8.0807; 8.0807; 8.0807 90; 90; 90 | 527.65 | Fukuoka, H.; Imoto, H.; Saito, T. Preparation of cubic niobium pyrophosphate containing Nb(IV) and topotactic extraction of phosphorus atoms Journal of Solid State Chemistry, 1995, 119, 98-106 |
| 1517733 | CIF | Nb O7 P1.81 | P a -3 | 8.0705; 8.0705; 8.0705 90; 90; 90 | 525.66 | Fukuoka, H.; Imoto, H.; Saito, T. Preparation of cubic niobium pyrophosphate containing Nb(IV) and topotactic extraction of phosphorus atoms Journal of Solid State Chemistry, 1995, 119, 98-106 |
| 1517734 | CIF | Nb O7 P1.8 | P a -3 | 8.0896; 8.0896; 8.0896 90; 90; 90 | 529.4 | Fukuoka, H.; Imoto, H.; Saito, T. Preparation of cubic niobium pyrophosphate containing Nb(IV) and topotactic extraction of phosphorus atoms Journal of Solid State Chemistry, 1995, 119, 98-106 |
| 1518352 | CIF | C3 H3 Cl Cu N3 S3 | P a -3 | 11.70071; 11.70071; 11.70071 90; 90; 90 | 1601.9 | Tominaka, S.; Hamoudi, H.; Suga, T.; Bennett, T. D.; Cairns, A. B.; Cheetham, A. K. Topochemical conversion of a dense metal‒organic framework from a crystalline insulator to an amorphous semiconductor Chem. Sci., 2015, 6, 1465 |
| 1518353 | CIF | C3 H3 Cl Cu N3 S3 | P a -3 | 11.74713; 11.74713; 11.74713 90; 90; 90 | 1621.05 | Tominaka, S.; Hamoudi, H.; Suga, T.; Bennett, T. D.; Cairns, A. B.; Cheetham, A. K. Topochemical conversion of a dense metal‒organic framework from a crystalline insulator to an amorphous semiconductor Chem. Sci., 2015, 6, 1465 |
| 1518354 | CIF | C3 H3 Cl Cu N3 S3 | P a -3 | 11.78842; 11.78842; 11.78842 90; 90; 90 | 1638.2 | Tominaka, S.; Hamoudi, H.; Suga, T.; Bennett, T. D.; Cairns, A. B.; Cheetham, A. K. Topochemical conversion of a dense metal‒organic framework from a crystalline insulator to an amorphous semiconductor Chem. Sci., 2015, 6, 1465 |
| 1519925 | CIF | C80 H56 Co7 F18 N16 O18 Si | P a -3 | 24.5063; 24.5063; 24.5063 90; 90; 90 | 14717.5 | Chen, Kai-Jie; Perry IV, John J.; Scott, Hayley S.; Yang, Qing-Yuan; Zaworotko, Michael J. Double-walled pyr topology networks from a novel fluoride-bridged heptanuclear metal cluster Chem. Sci., 2015, 6, 4784 |
| 1520587 | CIF | C31 H45.67 Al N2 O3 | P a -3 | 26.2561; 26.2561; 26.2561 90; 90; 90 | 18100.5 | Jones, Matthew D.; Brady, Lauren; McKeown, Paul; Buchard, Antoine; Schäfer, Pascal M.; Thomas, Lynne H.; Mahon, Mary F.; Woodman, Timothy J.; Lowe, John P. Metal influence on the iso- and hetero-selectivity of complexes of bipyrrolidine derived salan ligands for the polymerisation of rac-lactide Chem. Sci., 2015, 6, 5034 |
| 1520986 | CIF | Cs3 Mg2 N O17 P6 | P a -3 | 12.239; 12.239; 12.239 90; 90; 90 | 1833.32 | Feldmann, W.; l'Haridon, P.; Marchand, R. Synthesis and crystal structure determination of Cs3 Mg2 P6 O17 N : the first example of a nitrido-oxo-cyclo-hexa phosphate Journal of Solid State Chemistry, 2000, 153, 185-191 |
| 1521355 | CIF | Al0.72 Ga1.28 O6 Sr3 | P a -3 | 16.0195; 16.0195; 16.0195 90; 90; 90 | 4110.99 | Kahlenberg, V. Sr3 (Al0.36 Ga0.64)2 O6 - a new strontium aluminium gallate Crystal Research and Technology, 2000, 35, 1279-1287 |
| 1521485 | CIF | C60 Rb | P a -3 | 14.0163; 14.0163; 14.0163 90; 90; 90 | 2753.6 | Lappas, A.; Brown, C.M.; Prassides, K.; Kordatos, K.; Tanigaki, K.; Suard, E. Neutron diffraction study of the polymeric structure of Na2 Rb C60 Journal of Physics: Condensed Matter, 1999, 11, 371-381 |
| 1521523 | CIF | O7 P2 W | P a -3 | 7.9502; 7.9502; 7.9502 90; 90; 90 | 502.498 | Lisnyak, V.V.; Stus', N.V.; Belyavina, N.M.; Slobodyanik, N.S.; Markiv, V.Ya. Crystal structure of a novel cubic pyrophosphate W P2 O7 Journal of Alloys Compd., 2000, 309, 83-87 |
| 1522060 | CIF | Hf O7 V2 | P a -3 | 8.753; 8.753; 8.753 90; 90; 90 | 670.611 | Turquat, C.; Muller, C.; Nigrelli, E.; Leroux, C.; Soubeyroux, J.L.; Nihoul, G. Structural investigation of temperature-induced phase transitions in Hf V2 O7 The European Physical Journal Apllied Physics, 2000, 10, 15-27 |
| 1524099 | CIF | O8.85 Te3 U0.91 | P a -3 | 11.335; 11.335; 11.335 90; 90; 90 | 1456.35 | Brandstaetter, F. Non-stoichiometric, hydrothermally synthesized cliffordite TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-), 1981, 29, 1-8 |
| 1524230 | CIF | C15 Eu2.819 | P a -3 | 28.21; 28.21; 28.21 90; 90; 90 | 22449.6 | Claves, D.; Ksari-Habiles, Y.; Chouteau, G.; Touzain, P. Crystal chemistry of europium fullerides Solid State Communications, 1998, 106, 431-435 |
| 1525681 | CIF | I4 Si | P a -3 | 11.98; 11.98; 11.98 90; 90; 90 | 1719.37 | Biehl, E.; Schubert, U. Reaktionen von Siliciummonoxid mit Muenzmetallhalogeniden Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-), 2000, 131, 813-818 |
| 1525835 | CIF | Ge O2 | P a -3 | 4.4046; 4.4046; 4.4046 90; 90; 90 | 85.451 | Lodziana, Z.; Parlinski, K.; Hafner, J. Ab initio studies of high-pressure transformations in Ge O2 Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 63, 1341061-1341067 |
| 1526098 | CIF | Cs3 In3 O36 P12 | P a -3 | 14.885; 14.885; 14.885 90; 90; 90 | 3297.97 | Murashova, E.V.; Chudinova, N.N. Condensed cesium indium phosphates Neorganicheskie Materialy, 2001, 37, 1521-1524 |
| 1526102 | CIF | Ga2 O6 Sr3 | P a -3 | 16.095; 16.095; 16.095 90; 90; 90 | 4169.39 | Naganuma, J.; Matoba, M. Crystal Structure and Magnetization of Perovskite-related Ga Oxides, Sr~3~(Ga~1-x~Mn~x~)~2~O~6~ Nippon Oyo Jiki Gakkaishi, 2001, 25, 719-722 |
| 1526236 | CIF | F2 Mg | P a -3 | 4.7615; 4.7615; 4.7615 90; 90; 90 | 107.952 | Haines, J.; Klug, D.D.; Leger, J.M.; Gorelli, F.; Tse, J.S.; Li, Z.Q. X-ray diffraction and theoretical studies of the high-pressure structures and phase transitions in magnesium fluoride Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 64, 1341101-13411010 |
| 1526496 | CIF | Ir Te2 | P a -3 | 6.5547; 6.5547; 6.5547 90; 90; 90 | 281.617 | Jobic, S.; Pasturel, A.; Brec, R.; Koo, H.-J.; Whangbo Myunghwan Theoretical study of possible iridium ditelluride phases attainable under high pressure Journal of Solid State Chemistry, 2001, 162, 63-68 |
| 1526517 | CIF | Ga2 O6 Sr3 | P a -3 | 16.1049; 16.1049; 16.1049 90; 90; 90 | 4177.09 | Kahlenberg, V. The crystal structures of the strontium gallates Sr10 Ga6 O19 and Sr3 Ga2 O6 Journal of Solid State Chemistry, 2001, 160, 421-429 |
| 1526521 | CIF | Mo1.023 O8 W0.977 Zr | P a -3 | 9.14; 9.14; 9.14 90; 90; 90 | 763.552 | Kameswari, U.; Sleight, A.W.; Evans, J.S.O. Rapid synthesis of Zr W2 O8 and related phases, and structure refinement of Zr W Mo O8 International Journal of Inorganic Materials, 2000, 2, 333-337 |
| 1526711 | CIF | Al F6 H18 N6 Ru | P a -3 | 9.9872; 9.9872; 9.9872 90; 90; 90 | 996.165 | Subramanian, M.A.; Harlow, R.H.; Rao, V.N.M. New (Ru (N H3)6) M F6 phases: precursors to catalysts for halogenation reactions Materials Research Bulletin, 2000, 35, 1587-1592 |
| 1527404 | CIF | Cu3 O6 W | P a -3 | 9.797; 9.797; 9.797 90; 90; 90 | 940.328 | Gebert, E.; Kihlborg, L. The crystal structure of a new copper wolfram oxide, Cu3 W O6 Acta Chemica Scandinavica (1-27,1973-42,1988), 1969, 23, 221-231 |
| 1527472 | CIF | O7 P2 Zr | P a -3 | 8.2474; 8.2474; 8.2474 90; 90; 90 | 560.985 | Hagman, L.O.; Kierkegaard, P. Note on the structures of M(IV) P2 O 7 ( M(IV) = Ge, Zr, and U ) Acta Chemica Scandinavica (1-27,1973-42,1988), 1969, 23, 327-328 |
| 1527512 | CIF | Ir3 Te8 | P a -3 | 6.414; 6.414; 6.414 90; 90; 90 | 263.868 | Hockings, E.F.; White, J.G. The system iridium-tellurium Journal of Physical Chemistry, 1960, 64, 1042-1045 |
| 1527733 | CIF | Cl6 Co H16 N4 O2 Tl | P a -3 | 11.3; 11.3; 11.3 90; 90; 90 | 1442.9 | Linhard, M.; Plieth, K.; Manthey, W. Die Kristallstruktur des Diaquo-tetrammin-cobalt(III)-hexachloro-thallats, [Co(NH~3~)~4~(H~2~O)~2~ [TlCl~6~] Zeitschrift für Elektrochemie, Berichte der Bunsengesellschaft für physikalische Chemie, 1953, 57, 862-866 |
| 1528829 | CIF | C82 Ce | P a -3 | 15.78; 15.78; 15.78 90; 90; 90 | 3929.35 | Rikiishi, Y.; Kubozono, Y.; Hosokawa, T.; Takabayashi, Y.; Fujiwara, A.; Shibata, K.; Haruyama, Y.; Iwasa, Y.; Kobayashi, S.; Mori, S. Structural and electronic characterizations of two isomers of Ce@C82 J. Phys. Chem. B, 2004, 108, 7580-7585 |
| 1529273 | CIF HKL | F7 H12 N3 Sn | P a -3 | 12.0866; 12.0866; 12.0866 90; 90; 90 | 1765.68 | Flerov, Igor; Molokeev, Maxim; Laptash, Natalia; Udovenko, Anatoly; Pogoreltsev, Evgeniy; Melnikova, Svetlana; Misyul, Sergey Structural transformation between two cubic phases of (NH4)3SnF7 Journal of Fluorine Chemistry, 2015, 179, 86 |
| 1530133 | CIF | Pb3.96 S9 Sb2.04 Sn | P a -3 | 11.549; 11.549; 11.549 90; 90; 90 | 1540.4 | Kaplunnik, L.N.; Pobedimskaya, E.A.; Belov, N.V. The garnet-like structure of synthetic sulfo salt (Pb0.66 Sb0.34)6 Sn S9 Doklady Akademii Nauk SSSR, 1977, 237, 1086-1089 |
| 1530260 | CIF | Cs3 O36 P12 V3 | P a -3 | 14.543; 14.543; 14.543 90; 90; 90 | 3075.83 | Lavrov, A.V.; Vojtenkov, M.J.; Sadikov, G.G.; Nikolaev, V.P. The structure of crystals of dodecacyclophosphate Cs3 V3 P12 O36 Doklady Akademii Nauk SSSR, 1981, 259, 103-106 |
| 1530879 | CIF | O7 P2 Si | P a -3 | 7.473; 7.473; 7.473 90; 90; 90 | 417.335 | Tillmanns, E.; Baur, W.H.; Gebert, W. Computer Simulation of Crystal Structures applied to the Solution of the Superstructure of Cubic Silicon-diphosphate Journal of Solid State Chemistry, 1973, 7, 69-84 |
| 1531988 | CIF | Br7 Hg6 Sb5 | P a -3 | 12.978; 12.978; 12.978 90; 90; 90 | 2185.86 | Olenev, A.V.; Shatruk, M.M.; Popovkin, B.A.; Shevel'kov, A.V. Synthesis and crystal structure of the supramolecular solid solution (Hg6 Asx Sb4-x) (Sb Br6) Br Zhurnal Neorganicheskoi Khimii, 2001, 46, 1615-1618 |
| 1531990 | CIF | As1.46 Br7 Hg6 Sb3.54 | P a -3 | 12.775; 12.775; 12.775 90; 90; 90 | 2084.89 | Olenev, A.V.; Shatruk, M.M.; Popovkin, B.A.; Shevel'kov, A.V. Synthesis and crystal structure of the supramolecular solid solution (Hg6 Asx Sb4-x) (Sb Br6) Br Zhurnal Neorganicheskoi Khimii, 2001, 46, 1615-1618 |
| 1531992 | CIF | As2.206 Br7 Hg6 Sb2.794 | P a -3 | 12.704; 12.704; 12.704 90; 90; 90 | 2050.32 | Olenev, A.V.; Shatruk, M.M.; Shevel'kov, A.V.; Popovkin, B.A. Synthesis and crystal structure of the supramolecular solid solution (Hg6 Asx Sb4-x) (Sb Br6) Br Zhurnal Neorganicheskoi Khimii, 2001, 46, 1615-1618 |
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