Information card for entry 1506355

Structure parameters

• Chemical name: cis,cis,trans-diamminedichlorodibenzoylplatinum(IV)
• Formula: C22 H32 Cl2 N2 O6 Pt
• Calculated formula: C22 H32 Cl2 N2 O6 Pt
• SMILES: [Pt](Cl)(Cl)([NH3])([NH3])(OC(=O)c1ccccc1)OC(=O)c1ccccc1.O1CCCC1.O1CCCC1
• Title of publication: Synthesis and characterization of platinum(IV) anticancer drugs with functionalized aromatic carboxylate ligands: influence of the ligands on drug efficacies and uptake.
• Authors of publication: Ang, Wee Han; Pilet, Sébastien; Scopelliti, Rosario; Bussy, François; Juillerat-Jeanneret, Lucienne; Dyson, Paul J.
• Journal of publication: Journal of medicinal chemistry
• Year of publication: 2005
• Journal volume: 48
• Journal issue: 25
• Pages of publication: 8060 - 8069
• a: 7.7485 ± 0.0008 Å
• b: 18.294 ± 0.003 Å
• c: 18.356 ± 0.004 Å
• α: 90°
• β: 92.129 ± 0.011°
• γ: 90°
• Cell volume: 2600.2 ± 0.8 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0639
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.0917
• Weighted residual factors for all reflections included in the refinement: 0.1003
• Goodness-of-fit parameter for all reflections included in the refinement: 1.166
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No