Information card for entry 7108130

Structure parameters

• Formula: C76 H69 B2 F24 N5 Rh
• Calculated formula: C76 H69 B2 F24 N5 Rh
• Title of publication: Dimethylamine borane dehydrogenation chemistry: syntheses, X-ray and neutron diffraction studies of 18-electron aminoborane and 14-electron aminoboryl complexes
• Authors of publication: Christina Y. Tang; Nicholas Phillips; Joshua I. Bates; Amber L. Thompson; Matthias J. Gutmann; Simon Aldridge
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 8096
• a: 12.7649 ± 0.0002 Å
• b: 14.1705 ± 0.0002 Å
• c: 21.1902 ± 0.0004 Å
• α: 90°
• β: 93.284 ± 0.001°
• γ: 90°
• Cell volume: 3826.7 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0944
• Residual factor for significantly intense reflections: 0.0944
• Weighted residual factors for significantly intense reflections: 0.2349
• Weighted residual factors for all reflections included in the refinement: 0.2349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: neutron
• Diffraction radiation type: Neutron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No