Information card for entry 1570338

Structure parameters

• Chemical name: (5-acenaphthyl)fluoro(mesityl)borane
• Formula: C21 H20 B F
• Calculated formula: C21 H20 B F
• Title of publication: Rapid, iterative syntheses of unsymmetrical di- and triarylboranes from crystalline aryldifluoroboranes.
• Authors of publication: Turnbull, Douglas; Légaré, Marc-André
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 48
• Pages of publication: 14256 - 14261
• a: 8.3362 ± 0.001 Å
• b: 8.4445 ± 0.001 Å
• c: 12.8453 ± 0.0015 Å
• α: 87.107 ± 0.005°
• β: 82.251 ± 0.005°
• γ: 65.001 ± 0.005°
• Cell volume: 812.03 ± 0.17 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1048
• Residual factor for significantly intense reflections: 0.0691
• Weighted residual factors for significantly intense reflections: 0.1912
• Weighted residual factors for all reflections included in the refinement: 0.2144
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9942
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No