Information card for entry 7101353

Structure parameters

• Common name: Compound 1
• Formula: C79 H66 B F25 P3 Rh
• Calculated formula: C79 H66 B F25 P3 Rh
• Title of publication: Phosphine-Olefin Ligands: A Facile Dehydrogenative Route to Catalytically Active Rhodium Complexes
• Authors of publication: Andrew Weller; Simon Brayshaw; Thomas M. Douglas; Christopher Frost; J.Le Notre
• Journal of publication: Chemical Communications
• Year of publication: 2006
• Journal issue: 32
• a: 23.8394 ± 0.0002 Å
• b: 13.1178 ± 0.0001 Å
• c: 26.0538 ± 0.0002 Å
• α: 90°
• β: 113.063 ± 0.0003°
• γ: 90°
• Cell volume: 7496.37 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0683
• Residual factor for significantly intense reflections: 0.0416
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.1152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No