Information card for entry 4074267

Structure parameters

• Formula: C11 H17 F3 P Rh
• Calculated formula: C11 H17 F3 P Rh
• SMILES: [c]12([cH]3[cH]4[cH]5[cH]1[Rh]12345([CH2]=[CH2]1)[P](C)(C)C)C(F)(F)F
• Title of publication: Comparisons of Photoinduced Oxidative Addition of B−H, B−B, and Si−H Bonds at Rhodium(η5-cyclopentadienyl)phosphine Centers
• Authors of publication: Câmpian, Marius V.; Harris, Jeremy L.; Jasim, Naser; Perutz, Robin N.; Marder, Todd B.; Whitwood, Adrian C.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 21
• Pages of publication: 5093
• a: 10.7234 ± 0.0006 Å
• b: 14.3049 ± 0.0008 Å
• c: 16.7704 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2572.5 ± 0.3 ų
• Cell temperature: 115 ± 2 K
• Ambient diffraction temperature: 115 ± 2 K
• Number of distinct elements: 5
• 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: 0.0284
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0645
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No