Information card for entry 4077995

Structure parameters

• Formula: C32 H70 Br2 P2 Pt
• Calculated formula: C32 H70 Br2 P2 Pt
• SMILES: [P+]([C@H](CCC)[Pt](Br)(Br)[C@@H]([P+](CCCC)(CCCC)CCCC)CCC)(CCCC)(CCCC)CCCC
• Title of publication: Formation and Structure of a Platinum(II) Complex Containing TwotransNonstabilized Phosphorus Ylide Ligands: Evidence for Reversible Ylide Dissociation
• Authors of publication: Dub, Pavel A.; Béthegnies, Aurélien; Daran, Jean-Claude; Poli, Rinaldo
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 3081
• a: 9.5724 ± 0.0005 Å
• b: 9.8981 ± 0.0006 Å
• c: 10.3109 ± 0.0005 Å
• α: 99.468 ± 0.003°
• β: 94.966 ± 0.003°
• γ: 101.819 ± 0.003°
• Cell volume: 935.86 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1641
• Weighted residual factors for all reflections included in the refinement: 0.1771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No