Crystallography Open Database
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COD ID  |
Links | Formula |
Space group  |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1530787 | CIF | Na4 O12 Si3 Zr2 | R 3 c :R | 9.106; 9.106; 9.106 60.6; 60.6; 60.6 | 541.145 | Sizova, R.G.; Blinov, V.A.; Belov, N.V.; Voronkov, A.A.; Ilyukhin, V.V. The refined structure of Na4 Zr2 (Si O4)3 and its place in the series of mixed frameworks with the general formula M2 (T O4)3 Kristallografiya, 1981, 26, 293-300 |
| 1560398 | CIF | O3 Pb Ti0.4 Zr0.6 | R 3 c :R | 8.173; 8.173; 8.173 89.614; 89.614; 89.614 | 545.9 | Amin, A.; Newnham, R. E.; Cross, L. E.; Cox, D. E. Phenomenological and structural study of a low-temperature phase transition in the Pb Zr O3 - Pb Ti O3 system Journal of Solid State Chemistry, 1981, 37, 248-255 |
| 1566106 | CIF | C8 H12 I3 N Sn | R 3 c :R | 17.2991; 17.2991; 17.2991 117.373; 117.373; 117.373 | 2143.3 | Kamminga, Machteld E.; Gélvez-Rueda, María C.; Maheshwari, Sudeep; van Droffelaar, Irene S.; Baas, Jacob; Blake, Graeme R.; Grozema, Ferdinand C.; Palstra, Thomas T.M. Electronic mobility and crystal structures of 2,5-dimethylanilinium triiodide and tin-based organic-inorganic hybrid compounds Journal of Solid State Chemistry, 2019, 270, 593-600 |
| 2000652 | CIF Paper | Al2 H6 O12 Se3 | R 3 c :R | 8.3806; 8.3806; 8.3806 65.527; 65.527; 65.527 | 535.72 | Harrison, W. T. A.; Stucky, G. D.; Morris, R. E.; Cheetham, A. K. Synthesis and structure of aluminium selenite trihydrate, Al~2~(SeO~3~)~3~.3H~2~O Acta Crystallographica Section C, 1992, 48, 1365-1367 |
| 2003271 | CIF Paper | C15 H25 N3 O | R 3 c :R | 17.158; 17.158; 17.158 116.66; 116.66; 116.66 | 2344 | Anulewicz, R.; Fiertek, D.; Izdebski, J. 1-Cyclohexyl-2-cyclohexylamino-5(4<i>H</i>)-imidazolone Acta Crystallographica Section C, 1995, 51, 541-543 |
| 2003675 | CIF Paper | C6 H12 I6 N4 | R 3 c :R | 9.841; 9.841; 9.841 81.33; 81.33; 81.33 | 923.37 | Tebbe, K.-F.; Nagel, K. Urotropin-3-Diiod, Ur.3I~2~ Acta Crystallographica Section C, 1995, 51, 1388-1390 |
| 2310555 | CIF | O10 P4 | R 3 c :R | 7.43; 7.43; 7.43 87; 87; 87 | 408.543 | Cruickshank, D.W.J. Refinements of structures containing bonds between Si, P, S or Cl and O or N Acta Crystallographica (1,1948-23,1967), 1964, 17, 677-679 |
| 4030516 | CIF | Cr2 H6 O12 Se3 | R 3 c :R | 8.54; 8.54; 8.54 65.7; 65.7; 65.7 | 494.9 | Harrison, W. T. A.; Stucky, G. D.; Cheetham, A. K. The syntheses and crystal structures of the two trivalent metal selenites: InHSe2O6 and Cr2(SeO3)3.3H2O European Journal of Solid State and Inorganic Chemistry, 1993, 30, 347-356 |
| 4104533 | CIF | C9 H6 Fe2 O7 S2 | R 3 c :R | 14.4533; 14.4533; 14.4533 112.201; 112.201; 112.201 | 2056.1 | Tianbiao Liu; Bin Li; Michael L. Singleton; Michael B. Hall; Marcetta Y. Darensbourg Sulfur Oxygenates of Biomimetics of the Diiron Subsite of the [FeFe]-Hydrogenase Active Site: Properties and Oxygen Damage Repair Possibilities Journal of the American Chemical Society, 2009, 131, 8296-8307 |
| 4334463 | CIF | C21 H25 Ag0.35 B Br0.35 Cl N9 Ru | R 3 c :R | 16.0514; 16.0514; 16.0514 97.046; 97.046; 97.046 | 4033.4 | Francys E. Fernández; M. Carmen Puerta; Pedro Valerga Picolyl-NHC Hydrotris(pyrazolyl)borate Ruthenium(II) Complexes: Synthesis, Characterization, and Reactivity with Small Molecules Inorganic Chemistry, 2013, 52, 4396-4410 |
| 4350788 | CIF | C72 H86 B3 O14 Ta3 | R 3 c :R | 15.1087; 15.1087; 15.1087 94.35; 94.35; 94.35 | 3417.5 | Christian N. Garon; Maxime Daigle; Isabelle Levesque; Philippe Dufour; Hassan Iden; Christian Tessier; Thierry Maris; Jean-François Morin; Frédéric-Georges Fontaine On the Interaction of Acetone with Electrophilic Metallocavitands Having Extended Cavities Inorganic Chemistry, 2012, 51, 10384-10393 |
| 4504285 | CIF | B2 Ba O4 | R 3 c :R | 8.3824; 8.3824; 8.3824 96.86; 96.86; 96.86 | 575.22 | Pan, Shilie; Smit, Jared P.; Lanier, Courtney H.; Marvel, Michael R.; Marks, Laurence D.; Poeppelmeier, Kenneth R. Optical Floating Zone Growth of β-BaB2O4from a LiBa2B5O10-Based Solvent Crystal Growth & Design, 2007, 7, 1561 |
| 7004240 | CIF | C19 H22 F3 N2 O3 P S | R 3 c :R | 16.983; 16.983; 16.983 57.3; 57.3; 57.3 | 3248.3 | Benkő, Zoltán; Burck, Sebastian; Gudat, Dietrich; Nieger, Martin; Nyulászi, László; Shore, Nicholas Pyrido-annellated diazaphospholenes and phospholenium ions Dalton Transactions, 2008, 4937-4945 |
| 7009796 | CIF | C66 H96 Cu6 N6 O60 Pr2 | R 3 c :R | 18.186; 18.186; 18.186 69.784; 69.784; 69.784 | 5118.8 | Zhang, Yuan-Jing; Ma, Bao-Qing; Gao, Song; Li, Jun-Ran; Liu, Qin-De; Wen, Ge-Hui; Zhang, Xi-Xiang The first lanthanide-templated molecular wheel containing six copper ions † Journal of the Chemical Society, Dalton Transactions, 2000, 2249 |
| 7013892 | CIF | C20 H40 Cl2 O18 Sm | R 3 c :R | 17.903; 17.903; 17.903 108.35; 108.35; 108.35 | 4592 | Starynowicz, Przemysław Two complexes of Sm(II) with crown ethers-electrochemical synthesis, structure and spectroscopy. Dalton transactions (Cambridge, England : 2003), 2004, 825-832 |
| 7013893 | CIF | C20 H40 Cl2 O18 Sm | R 3 c :R | 18.053; 18.053; 18.053 108.3; 108.3; 108.3 | 4715 | Starynowicz, Przemysław Two complexes of Sm(II) with crown ethers-electrochemical synthesis, structure and spectroscopy. Dalton transactions (Cambridge, England : 2003), 2004, 825-832 |
| 9013407 | CIF | Na Nb O3 | R 3 c :R | 7.8147; 7.8147; 7.8147 89.17; 89.17; 89.17 | 477.091 | Seidel, P.; Hoffmann, W. Verfeinerung der kristallstruktur von NaNbO3 N. Bestimmung der absoluten konfiguration und des zwillingsgesetzes Note T = 84 K Zeitschrift fur Kristallographie, 1976, 143, 444-459 |
| 9017518 | CIF | Fe O3 | R 3 c :R | 5.43; 5.43; 5.43 55.28; 55.28; 55.28 | 100.792 | Pauling, L.; Hendricks, S. The Structure of Hematite Journal of the American Chemical Society, 1925, 47, 781-790 |
| 1000070 | CIF | Li Nb O6 W | R 3 c :H | 5.1562; 5.1562; 13.664 90; 90; 120 | 314.6 | Fourquet, J L; Le Bail, A; Gillet, P A Li Nb W O~6~: Crystal structure of its two allotropic forms Materials Research Bulletin, 1988, 23, 1163-1170 |
| 1001090 | CIF | Bi Fe O3 | R 3 c :H | 5.5876; 5.5876; 13.867 90; 90; 120 | 374.9 | Moreau, J M; Michel, C; Gerson, R; James, W J Ferroelectric Bi Fe O~3~ X-Ray and neutron diffraction study Journal of Physics and Chemistry of Solids, 1971, 32, 1315-1320 |
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