Information card for entry 4075956

Structure parameters

• Formula: C76 H77 Cl7 P Rh
• Calculated formula: C76.42 H75 Cl3.37 P Rh
• Title of publication: A Bowl-Shaped Phosphine as a Ligand in Rhodium-Catalyzed Hydrosilylation: Rate Enhancement by a Mono(phosphine) Rhodium Species
• Authors of publication: Niyomura, Osamu; Iwasawa, Tetsuo; Sawada, Naoki; Tokunaga, Makoto; Obora, Yasushi; Tsuji, Yasushi
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 14
• Pages of publication: 3468
• a: 16.4206 ± 0.0009 Å
• b: 19.2472 ± 0.0009 Å
• c: 22.0247 ± 0.0011 Å
• α: 90°
• β: 105.54 ± 0.002°
• γ: 90°
• Cell volume: 6706.5 ± 0.6 ų
• Cell temperature: 93.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 0.836
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No