Information card for entry 7110964

Structure parameters

• Formula: C29.5 H22 F2 I3 O P2 Rh
• Calculated formula: C29.5 H22 F2 I3 O P2 Rh
• Title of publication: Rhodium(i) complexes of unsymmetrical diphosphines: efficient and stable methanol carbonylation catalysts
• Authors of publication: Carraz, Charles-Antoine; Orpen, A. Guy; Ellis, Dianne D.; Pringle, Paul G.; Ditzel, Evert J.; Sunley, Glenn J.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 14
• Pages of publication: 1277
• a: 18.85 ± 0.003 Å
• b: 15.338 ± 0.004 Å
• c: 20.992 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6069 ± 2 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: 0.0526
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for all reflections: 0.0981
• Weighted residual factors for significantly intense reflections: 0.0854
• Goodness-of-fit parameter for all reflections: 1.165
• Goodness-of-fit parameter for significantly intense reflections: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No