Information card for entry 7721002

Structure parameters

• Formula: C41 H49 B9 N O2.5 P Rh
• Calculated formula: C39 H44 B9 N O2 P Rh
• Title of publication: Rhodacarborane complexes with a triphenylphosphonium substituent as efficient catalysts for on-water transfer hydrogenation of carbonyl compounds
• Authors of publication: Vinogradov, Mikhail M.; Nelubina, Yulia V.; Godovikov, Ivan A.; Godovikova, Maria I.; Kharitonov, Vladimir B.; Podyacheva, Evgeniya S.; Rodionov, Alexey
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 18.6491 ± 0.0003 Å
• b: 21.7922 ± 0.0004 Å
• c: 22.7209 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9233.9 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.07
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No