Information card for entry 7121374

Structure parameters

• Formula: C20 H32 B Br2 N
• Calculated formula: C20 H32 B Br2 N
• Title of publication: Direct access to a cAAC-supported dihydrodiborene and its dianion.
• Authors of publication: Arrowsmith, Merle; Mattock, James D.; Böhnke, Julian; Krummenacher, Ivo; Vargas, Alfredo; Braunschweig, Holger
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 37
• Pages of publication: 4669 - 4672
• a: 9.5378 ± 0.0018 Å
• b: 17.709 ± 0.003 Å
• c: 12.56 ± 0.002 Å
• α: 90°
• β: 100.556 ± 0.004°
• γ: 90°
• Cell volume: 2085.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0518
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0527
• Weighted residual factors for all reflections included in the refinement: 0.0577
• 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: No
• Has Fobs: No