Information card for entry 4304531

Structure parameters

• Chemical name: cis-bis(triphenylphosphine)-bis(9-methylguanine,N7)-platinum(II) bis(nitrate) dimethylformamide solvate
• Formula: C50 H68 N16 O12 P2 Pt
• Calculated formula: C50 H68 N16 O12 P2 Pt
• SMILES: [Pt]([n]1c2c(nc([nH]c2=O)N)n(c1)C)([n]1c2c(nc([nH]c2=O)N)n(c1)C)([P](C)(c1ccccc1)c1ccccc1)[P](C)(c1ccccc1)c1ccccc1.N(=O)(=O)[O-].N(=O)(=O)[O-].N(C)(C)C=O.N(C)(C)C=O.N(C)(C)C=O.N(C)(C)C=O
• Title of publication: Role of the Phosphine Ligands on the Stabilization of Monoadducts of the Model Nucleobases 1-Methylcytosine and 9-Methylguanine in Platinum(II) Complexes
• Authors of publication: Diego Montagner; Ennio Zangrando; Bruno Longato
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 2688 - 2695
• a: 11.754 ± 0.003 Å
• b: 15.387 ± 0.003 Å
• c: 18.652 ± 0.004 Å
• α: 68.05 ± 0.03°
• β: 76.46 ± 0.03°
• γ: 76.54 ± 0.03°
• Cell volume: 3002.2 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1225
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1087
• Weighted residual factors for all reflections included in the refinement: 0.1212
• Goodness-of-fit parameter for all reflections included in the refinement: 0.834
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No