Information card for entry 4085059

Structure parameters

• Formula: C36 H27 B2 F15 Si2
• Calculated formula: C36 H27 B2 F15 Si2
• SMILES: B1([C@@]2([Si](C)(C)C)C(B(c3c(F)c(F)c(F)c(F)c3F)c3c(F)c(F)c(F)c(F)c3F)=C([C@]1([Si](C)(C)C)CC2)c1c(F)c(F)c(F)c(F)c1F)c1ccccc1
• 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: 11.4995 ± 0.0005 Å
• b: 11.7259 ± 0.0005 Å
• c: 14.345 ± 0.0005 Å
• α: 106.539 ± 0.002°
• β: 97.51 ± 0.002°
• γ: 92.816 ± 0.002°
• Cell volume: 1830.77 ± 0.13 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: 0.0471
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No