Information card for entry 4111623

Structure parameters

• Common name: RhP2O2Tol
• Formula: C59.5 H49.5 Cl1.5 F18 O4 P2 Rh
• Calculated formula: C59 H49 F18 O4 P2 Rh
• Title of publication: Direct C-Arylation of Free (NH)-Indoles and Pyrroles Catalyzed by Ar-Rh(III) Complexes Assembled In Situ
• Authors of publication: Xiang Wang; Benjamin S. Lane; Dalibor Sames
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• Journal volume: 127
• Pages of publication: 4996 - 4997
• a: 12.9032 ± 0.001 Å
• b: 13.8547 ± 0.0011 Å
• c: 18.2539 ± 0.0013 Å
• α: 90.146 ± 0.002°
• β: 101.1 ± 0.002°
• γ: 93.66 ± 0.001°
• Cell volume: 3195.3 ± 0.4 ų
• Cell temperature: 243 ± 2 K
• Ambient diffraction temperature: 243 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1487
• Residual factor for significantly intense reflections: 0.0708
• Weighted residual factors for significantly intense reflections: 0.1866
• Weighted residual factors for all reflections included in the refinement: 0.2114
• Goodness-of-fit parameter for all reflections included in the refinement: 0.943
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No