Information card for entry 4078120

Structure parameters

• Formula: C11 H24 B10 Si
• Calculated formula: C11 H24 B10 Si
• SMILES: [Si](C12[C]3456[C]789(C(C=C1)C=C2)[BH]123[BH]3%107[BH]7%118[BH]849[BH]49%11[BH]%11%107[BH]723[BH]251[BH]684[BH]9%1172)(C)(C)C
• Title of publication: Reaction of Carboryne with Alkylbenzenes
• Authors of publication: Wang, Sunewang Rixin; Xie, Zuowei
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 3316
• a: 13.8031 ± 0.0007 Å
• b: 14.163 ± 0.0008 Å
• c: 18.1401 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3546.3 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0543
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1168
• Weighted residual factors for all reflections included in the refinement: 0.1341
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No