Information card for entry 2201361

Structure parameters

• Chemical name: trans-Carbonylchlorobis(tribenzylphosphine)rhodium(I)
• Formula: C43 H42 Cl O P2 Rh
• Calculated formula: C43 H42 Cl O P2 Rh
• SMILES: [P]([Rh]([P](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1)(C#[O])Cl)(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1
• Title of publication: <i>trans</i>-Carbonylchlorobis(tribenzylphosphine)rhodium(I)
• Authors of publication: Muller, Alfred; Roodt, Andreas; Otto, Stefanus; Oskarsson, Åke; Yong, Shen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 12
• Pages of publication: m715 - m717
• a: 10.031 ± 0.001 Å
• b: 10.165 ± 0.001 Å
• c: 18.991 ± 0.0019 Å
• α: 93.36 ± 0.03°
• β: 90.37 ± 0.03°
• γ: 103.69 ± 0.03°
• Cell volume: 1877.8 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.1463
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for all reflections: 0.1218
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.0913
• Goodness-of-fit parameter for all reflections included in the refinement: 0.88
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No