Information card for entry 7109899

Structure parameters

• Formula: C32 H54 N2 O2 Si5
• Calculated formula: C32 H54 N2 O2 Si5
• SMILES: [Si]12(C(=NC(=N2)c2ccc(OC)cc2)c2ccc(OC)cc2)C([Si](C)(C)C)([Si](C)(C)C)CCC1([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Reactions of an isolable dialkylsilylene with aromatic nitriles providing a new type of heterosilole
• Authors of publication: Liliang Wang; Weifeng Chen; Zhifang Li; Xu-Qiong Xiao; Guoqiao Lai; Xupeng Liu; Zheng Xu; Mitsuo Kira
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 9776
• a: 17.925 ± 0.0019 Å
• b: 19.611 ± 0.002 Å
• c: 11.0217 ± 0.0012 Å
• α: 90°
• β: 102.677 ± 0.002°
• γ: 90°
• Cell volume: 3780 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0986
• Residual factor for significantly intense reflections: 0.0561
• Weighted residual factors for significantly intense reflections: 0.152
• Weighted residual factors for all reflections included in the refinement: 0.1871
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No