Information card for entry 4116846

Structure parameters

• Formula: C10 H12 Cl2 N2 Si
• Calculated formula: C10 H12 Cl2 N2 Si
• SMILES: c1cccc[n]1[SiH2](Cl)([n]1ccccc1)Cl
• Title of publication: Experimental Investigations and ab Initio Studies on Hexacoordinated Complexes of Dichlorosilane
• Authors of publication: Karl Hensen; Thorsten Stumpf; Michael Bolte; Christian Näther; Holger Fleischer
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 1998
• Journal volume: 120
• Pages of publication: 10402 - 10408
• a: 15.4608 ± 0.0001 Å
• b: 6.166 ± 0.0001 Å
• c: 14.3313 ± 0.0002 Å
• α: 90°
• β: 118.576 ± 0.001°
• γ: 90°
• Cell volume: 1199.79 ± 0.03 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 5
• 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: 0.0401
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for all reflections: 0.0696
• Weighted residual factors for significantly intense reflections: 0.0656
• Goodness-of-fit parameter for all reflections: 1.116
• Goodness-of-fit parameter for significantly intense reflections: 1.145
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No