Information card for entry 7105788

Structure parameters

• Formula: C35.5 H51 B N6 P Rh
• Calculated formula: C35.5 H51 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: 11.6549 ± 0.0008 Å
• b: 12.9893 ± 0.0009 Å
• c: 22.6123 ± 0.0015 Å
• α: 90°
• β: 90.483 ± 0.003°
• γ: 90°
• Cell volume: 3423.1 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No