Information card for entry 7717094

Structure parameters

• Formula: C21 H22 Cl F3 N3 O5 Rh S
• Calculated formula: C21 H22 Cl F3 N3 O5 Rh S
• Title of publication: Redox Properties of [Cp*Rh] Complexes Supported by Mono-substituted 2,2′-Bipyridyl Ligands
• Authors of publication: Stiel, Jonah P.; Henke, Wade C.; Moore, William N. G.; Barker, Nathaniel M.; Oliver, Allen Grayson; Day, Victor W.; Blakemore, James
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 15.898 ± 0.003 Å
• b: 22.527 ± 0.005 Å
• c: 13.676 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4897.8 ± 1.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 8
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0935
• Residual factor for significantly intense reflections: 0.0772
• Weighted residual factors for significantly intense reflections: 0.1486
• Weighted residual factors for all reflections included in the refinement: 0.1534
• Goodness-of-fit parameter for all reflections included in the refinement: 1.38
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No