Information card for entry 4077770

Structure parameters

• Formula: C32 H31 Cl11 D3 O2 P Pt
• Calculated formula: C32 H34 Cl11 O2 P Pt
• SMILES: [Pt]12(Cl)(Cl)[C@H]3[C@@H](CC[CH]1=[CH]2CC3)[C@@H]([P+](c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.[Pt]12(Cl)(Cl)[C@@H]3[C@H](CC[CH]1=[CH]2CC3)[C@H]([P+](c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl.C(Cl)(Cl)Cl
• Title of publication: Nucleophilic Attack of Carbonyl-Stabilized Phosphorus Ylides on 1,5-Cyclooctadiene Complexes of Palladium and Platinum
• Authors of publication: Vicente, José; Chicote, María-Teresa; MacBeath, Calum; Fernández-Baeza, Juan; Bautista, Delia
• Journal of publication: Organometallics
• Year of publication: 1999
• Journal volume: 18
• Journal issue: 14
• Pages of publication: 2677
• a: 17.7921 ± 0.0013 Å
• b: 18.3983 ± 0.0015 Å
• c: 25.016 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8188.8 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0998
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections: 0.1509
• Weighted residual factors for significantly intense reflections: 0.1321
• Goodness-of-fit parameter for all reflections: 1.036
• Goodness-of-fit parameter for significantly intense reflections: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No