Information card for entry 4084709

Structure parameters

• Formula: C29 H57 N S2 Si5
• Calculated formula: C29 H57 N S2 Si5
• SMILES: S1[Si]2(S/C1=N\c1c(cccc1C(C)C)C(C)C)C([Si](C)(C)C)([Si](C)(C)C)CCC2([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Reactions of an Isolable Dialkylsilylene with Carbon Dioxide and Related Heterocumulenes
• Authors of publication: Liu, Xupeng; Xiao, Xu-Qiong; Xu, Zheng; Yang, Xuemin; Li, Zhifang; Dong, Zhaowen; Yan, Chenting; Lai, Guoqiao; Kira, Mitsuo
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 19
• Pages of publication: 5434
• a: 11.323 ± 0.002 Å
• b: 11.883 ± 0.002 Å
• c: 15.335 ± 0.003 Å
• α: 77.249 ± 0.003°
• β: 68.794 ± 0.003°
• γ: 74.553 ± 0.003°
• Cell volume: 1836.3 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.073
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.1412
• Weighted residual factors for all reflections included in the refinement: 0.1645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No