Information card for entry 7105784

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: 9.9941 ± 0.0003 Å
• b: 11.595 ± 0.0003 Å
• c: 13.1114 ± 0.0003 Å
• α: 84.798 ± 0.001°
• β: 71.666 ± 0.001°
• γ: 77.102 ± 0.002°
• Cell volume: 1405.51 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0321
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0586
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No