Information card for entry 7042860

Structure parameters

• Chemical name: methyltrichlorosilane
• Formula: C H3 Cl3 Si
• Calculated formula: C H3 Cl3 Si
• SMILES: Cl[Si](Cl)(Cl)C
• Title of publication: Molecular structures of various alkyldichlorosilanes in the solid state
• Authors of publication: Wagler, Jörg; Gericke, Robert
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 9.877 ± 0.0008 Å
• b: 6.3981 ± 0.0003 Å
• c: 9.8704 ± 0.0007 Å
• α: 90°
• β: 103.471 ± 0.006°
• γ: 90°
• Cell volume: 606.59 ± 0.07 ų
• Cell temperature: 165 ± 2 K
• Ambient diffraction temperature: 165 ± 2 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.0503
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No