Information card for entry 2003434

Structure parameters

• Common name: JM216
• Chemical name: Bis(acetato)-ammine-dichloro-cyclohexylamine platinum(IV)
• Formula: C10 H22 Cl2 N2 O4 Pt
• Calculated formula: C10 H22 Cl2 N2 O4 Pt
• SMILES: [Pt](Cl)(Cl)(OC(=O)C)(OC(=O)C)([NH3])[NH2]C1CCCCC1
• Title of publication: Bis(acetato)amminedichloro(cyclohexylamine)platinum(IV), an Orally Active Anticancer Drug
• Authors of publication: Neidle, S.; Snook, C. F.; Murrer, B. A.; Barnard, C. F. J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 822 - 824
• a: 13.588 ± 0.002 Å
• b: 8.286 ± 0.001 Å
• c: 14.683 ± 0.002 Å
• α: 90°
• β: 110.51 ± 0.01°
• γ: 90°
• Cell volume: 1548.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections: 0.1147
• Weighted residual factors for significantly intense reflections: 0.111
• Goodness-of-fit parameter for all reflections: 0.971
• Goodness-of-fit parameter for significantly intense reflections: 0.981
• Diffraction radiation wavelength: 1.54051 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No