Information card for entry 4086100

Structure parameters

• Formula: C37 H30 Bi Cl3 P2 Pt
• Calculated formula: C37 H30 Bi Cl3 P2 Pt
• SMILES: [Bi]12[Pt](Cl)([P](c3c1cccc3)(c1ccccc1)c1ccccc1)[P](c1c2cccc1)(c1ccccc1)c1ccccc1.ClCCl
• Title of publication: PBiP Pincer Complexes of Platinum, Palladium, and Iridium Featuring Metal‒Metal Bonds Synthesized by Oxidative Addition of Bismuth‒Halide Bonds
• Authors of publication: Tschersich, Carolin; Braun, Beatrice; Herwig, Christian; Limberg, Christian
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 15
• Pages of publication: 3782
• a: 10.031 ± 0.001 Å
• b: 13.0693 ± 0.0012 Å
• c: 13.4585 ± 0.0013 Å
• α: 80.455 ± 0.003°
• β: 78.372 ± 0.003°
• γ: 86.488 ± 0.003°
• Cell volume: 1703.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0163
• Residual factor for significantly intense reflections: 0.015
• Weighted residual factors for significantly intense reflections: 0.0343
• Weighted residual factors for all reflections included in the refinement: 0.0348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No