Information card for entry 4085061

Structure parameters

• Formula: C42 H26 B2 Cl2 F14 N2 Si
• Calculated formula: C42 H26 B2 Cl2 F14 N2 Si
• Title of publication: Reactions of Boroles Formed by 1,1-Carboboration
• Authors of publication: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 1
• Pages of publication: 229
• a: 9.9195 ± 0.0003 Å
• b: 20.1849 ± 0.0006 Å
• c: 20.2529 ± 0.0006 Å
• α: 90°
• β: 93.012 ± 0.001°
• γ: 90°
• Cell volume: 4049.5 ± 0.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 7
• 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: 0.0606
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1332
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No