Information card for entry 4065628

Structure parameters

• Formula: C6 H12 Cl8 Si4
• Calculated formula: C6 H12 Cl8 Si4
• SMILES: C1[C@@H]([Si](C[C@H]([Si]1(Cl)Cl)[Si](C)(Cl)Cl)(Cl)Cl)[Si](C)(Cl)Cl
• Title of publication: [Bu4P]+Cl−-Catalyzed Reactions of Trichlorosilane and Dichloromethylsilane with Vinyltrichlorosilane: New Synthetic Method for 1,1,4,4-Tetrachloro-2,5-bis(trichlorosilyl)-1,4-disilacyclohexane Compounds
• Authors of publication: Hong, Soon Hyun; Hyun, Sang Il; Jung, Il Nam; Han, Won-Sik; Kim, Min-Hye; Yun, Hoseop; Nam, Suk-Woo; Kang, Sang Ook
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 13
• Pages of publication: 3054
• a: 6.7991 ± 0.0003 Å
• b: 8.6802 ± 0.0004 Å
• c: 9.2531 ± 0.0005 Å
• α: 84.1808 ± 0.0018°
• β: 67.1898 ± 0.0019°
• γ: 71.4251 ± 0.0011°
• Cell volume: 477.01 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0291
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0831
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.22
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No