Information card for entry 4069363

Structure parameters

• Formula: C32 H31 N2 O9 P Pt
• Calculated formula: C32 H31 N2 O9 P Pt
• SMILES: [Pt]1(OC(=CC(=[O]1)C)C)([P](c1ccccc1)(c1ccccc1)c1ccccc1)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: 9.4446 ± 0.0006 Å
• b: 10.1492 ± 0.0006 Å
• c: 16.6855 ± 0.0011 Å
• α: 87.571 ± 0.004°
• β: 86.83 ± 0.004°
• γ: 77.603 ± 0.004°
• Cell volume: 1558.94 ± 0.17 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 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: 0.0327
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0461
• Weighted residual factors for all reflections included in the refinement: 0.0477
• Goodness-of-fit parameter for all reflections included in the refinement: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No