Information card for entry 4083705

Structure parameters

• Formula: C11 H20 B P
• Calculated formula: C11 H20 B P
• Title of publication: Insights into the Formation of Borabenzene Adducts via Ligand Exchange Reactions and TMSCl Elimination from Boracyclohexadiene Precursors
• Authors of publication: Légaré, Marc-André; Bélanger-Chabot, Guillaume; De Robillard, Guillaume; Languérand, André; Maron, Laurent; Fontaine, Frédéric-Georges
• Journal of publication: Organometallics
• Year of publication: 2014
• Pages of publication: 140618164232002
• a: 28.277 ± 0.005 Å
• b: 6.1405 ± 0.0011 Å
• c: 17.939 ± 0.003 Å
• α: 90°
• β: 126.401 ± 0.002°
• γ: 90°
• Cell volume: 2507.1 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0846
• Residual factor for significantly intense reflections: 0.0502
• Weighted residual factors for significantly intense reflections: 0.1127
• Weighted residual factors for all reflections included in the refinement: 0.1297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No