Information card for entry 4069361

Structure parameters

• Formula: C29 H30 Cl N2 O7 P Pt S
• Calculated formula: C29 H30 Cl N2 O7 P Pt S
• SMILES: [Pt]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([S](C)C)(Cl)c1c(N(=O)=O)c(OC)c(OC)c(OC)c1N(=O)=O
• Title of publication: Mono(2,6-dinitroaryl)platinum(II) and Mono- and Bis(2,6-dinitroaryl)platinum(IV) Complexes
• Authors of publication: Vicente, José; Arcas, Aurelia; Gálvez-López, María-Dolores; Jones, Peter G.; Bautista, Delia
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 12
• Pages of publication: 3501
• a: 9.6776 ± 0.0004 Å
• b: 10.6644 ± 0.0004 Å
• c: 16.2538 ± 0.0006 Å
• α: 72.051 ± 0.004°
• β: 86.321 ± 0.004°
• γ: 72.729 ± 0.004°
• Cell volume: 1523.2 ± 0.11 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0171
• Residual factor for significantly intense reflections: 0.016
• Weighted residual factors for significantly intense reflections: 0.0402
• Weighted residual factors for all reflections included in the refinement: 0.0407
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No