Information card for entry 4333352

Structure parameters

• Formula: C H8 B4 N2 O12
• Calculated formula: B4 H12 N2 O10.41
• Title of publication: Preparation of Ammonia Borane in High Yield and Purity, Methanolysis, and Regeneration
• Authors of publication: Ramachandran, P. Veeraraghavan; Gagare, Pravin D.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 19
• Pages of publication: 7810 - 7817
• a: 7.1997 ± 0.0008 Å
• b: 10.6039 ± 0.001 Å
• c: 7.2604 ± 0.0008 Å
• α: 90°
• β: 98.537 ± 0.006°
• γ: 90°
• Cell volume: 548.15 ± 0.1 ų
• Cell temperature: 260 ± 2 K
• Ambient diffraction temperature: 260 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0748
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1691
• Weighted residual factors for all reflections included in the refinement: 0.1797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No