Information card for entry 1566620

Structure parameters

• Formula: C43 H39 B F3 O3 P2 Rh
• Calculated formula: C43 H39 B F3 O3 P2 Rh
• Title of publication: Electrostatic vs. Inductive Effects in Phosphine Ligand Donor Properties and Reactivity
• Authors of publication: Kelty, Margaret L.; McNeece, Andrew J.; Kurutz, Josh W.; Filatov, Alexander S.; Anderson, John S.
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 9.1533 ± 0.0006 Å
• b: 13.0253 ± 0.0009 Å
• c: 33.273 ± 0.002 Å
• α: 83.172 ± 0.002°
• β: 88.634 ± 0.002°
• γ: 79.181 ± 0.002°
• Cell volume: 3868.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.084
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.0802
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No