Information card for entry 4126141

Structure parameters

• Formula: C62 H80 Cl14 F24 N8 P4 Rh2 Sb4
• Calculated formula: C62 H80 Cl14 F24 N8 P4 Rh2 Sb4
• Title of publication: α-Dicationic Chelating Phosphines: Synthesis and Application to the Hydroarylation of Dienes.
• Authors of publication: Gu, Lianghu; Wolf, Lawrence M.; Zieliński, Adam; Thiel, Walter; Alcarazo, Manuel
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 13
• Pages of publication: 4948 - 4953
• a: 13.2883 ± 0.0012 Å
• b: 13.0485 ± 0.0016 Å
• c: 26.3951 ± 0.0012 Å
• α: 90°
• β: 92.308 ± 0.007°
• γ: 90°
• Cell volume: 4573 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0672
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1638
• Weighted residual factors for all reflections included in the refinement: 0.1762
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No