Information card for entry 7117817

Structure parameters

• Formula: C24 H57 B O3 P3 Rh
• Calculated formula: C24 H57 B O3 P3 Rh
• SMILES: [Rh]([P](CC)(CC)CC)([P](CC)(CC)CC)([P](CC)(CC)CC)OB1OC(C)(C(O1)(C)C)C
• Title of publication: Remarkable reactivity of a rhodium(I) boryl complex towards CO2 and CS2: isolation of a carbido complex
• Authors of publication: Sabrina I. Kallane; Thomas Braun; Michael Teltewskoi; Beatrice Braun; Roy Herrmann; Reik Laubenstein
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 14613
• a: 10.8214 ± 0.0008 Å
• b: 13.3028 ± 0.0006 Å
• c: 11.7681 ± 0.0009 Å
• α: 90°
• β: 113.017 ± 0.003°
• γ: 90°
• Cell volume: 1559.21 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0225
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0611
• Weighted residual factors for all reflections included in the refinement: 0.0611
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No