Information card for entry 7105787

Structure parameters

• Formula: C61 H48 B2 N14 Rh2
• Calculated formula: C61 H48 B2 N14 Rh2
• 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: 11.5334 ± 0.0005 Å
• b: 15.3688 ± 0.0006 Å
• c: 15.8442 ± 0.0006 Å
• α: 93.813 ± 0.002°
• β: 100.089 ± 0.002°
• γ: 111.872 ± 0.002°
• Cell volume: 2539.18 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.071
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No