Information card for entry 2011425

Structure parameters

• Formula: C26 H40 Cl6 N12 Si2
• Calculated formula: C26 H40 Cl6 N12 Si2
• SMILES: C([Si](Cl)(Cl)([n]1cn(C)cc1)([n]1cn(C)cc1)[n]1cn(C)cc1)C[Si](Cl)(Cl)([n]1cn(C)cc1)([n]1cn(C)cc1)[n]1cn(C)cc1.[Cl-].[Cl-]
• Title of publication: The addition-reaction product of 1,1,1,4,4,4-hexachloro-1,4-disilabutane with <i>N</i>-methylimidazole
• Authors of publication: Hensen, Karl; Spangenberg, Björn; Bolte, Michael
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 10
• Pages of publication: 1245 - 1246
• a: 13.8976 ± 0.0001 Å
• b: 7.5553 ± 0.0001 Å
• c: 17.3704 ± 0.0002 Å
• α: 90°
• β: 97.947 ± 0.001°
• γ: 90°
• Cell volume: 1806.39 ± 0.03 ų
• Cell temperature: 133 K
• Ambient diffraction temperature: 133 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0637
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections: 0.0847
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.0847
• Goodness-of-fit parameter for all reflections: 1.078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes