Information card for entry 4120678

Structure parameters

• Formula: C34 H23 B2 F15 Si2
• Calculated formula: C34 H23 B2 F15 Si2
• SMILES: [Si](C1B(C([Si](C)(C)C)=C(C=1B(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1ccccc1)(C)(C)C
• Title of publication: Borole formation by 1,1-carboboration.
• Authors of publication: Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 1
• Pages of publication: 68 - 71
• a: 10.8632 ± 0.0004 Å
• b: 11.8992 ± 0.0006 Å
• c: 14.8632 ± 0.0009 Å
• α: 81.215 ± 0.004°
• β: 84.155 ± 0.003°
• γ: 68.825 ± 0.003°
• Cell volume: 1768.26 ± 0.16 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0744
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.117
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No