Information card for entry 7105785

Structure parameters

• Formula: C31 H33 B N6 P Rh
• Calculated formula: C31 H33 B N6 P Rh
• Title of publication: Double addition of H2 to transition metal–borane complexes: a ‘hydride shuttle’ process between boron and transition metal centres
• Authors of publication: Nikolaos Tsoureas; Yu-Ying Kuo; Mairi Haddow; Gareth Owen
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 484
• a: 19.3135 ± 0.0017 Å
• b: 20.0036 ± 0.0017 Å
• c: 14.4432 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5580 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0394
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0696
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No