Information card for entry 7108994

Structure parameters

• Formula: C32 H96 Si18
• Calculated formula: C32 H96 Si18
• SMILES: C[Si](C)(C)[Si@]12[Si@]3([Si@@]([Si@]1([Si]([Si](C)(C)[Si]2(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)([Si]([Si](C)(C)[Si]3(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C.C[Si](C)(C)[Si@@]12[Si@@]3([Si@]([Si@@]1([Si]([Si](C)(C)[Si]2(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)([Si]([Si](C)(C)[Si]3(C)C)([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
• Title of publication: Reduction of the dihalocyclopentasilanes. A quest for a homocyclic silylene
• Authors of publication: Xu-Qiong Xiao; Hui Zhao; Zheng Xu; Guoqiao Lai; Xiao-Lin He; Zhifang Li
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 2706
• a: 27.289 ± 0.002 Å
• b: 12.4843 ± 0.001 Å
• c: 20.2377 ± 0.0016 Å
• α: 90°
• β: 113.001 ± 0.001°
• γ: 90°
• Cell volume: 6346.5 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0488
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.1114
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 0.899
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No