Information card for entry 4104378

Structure parameters

• Chemical name: Trichlorosilane-bis(p-tert-butylpyridine)
• Formula: C18 H27 Cl3 N2 Si
• Calculated formula: C18 H27 Cl3 N2 Si
• SMILES: [SiH](Cl)(Cl)(Cl)([n]1ccc(cc1)C(C)(C)C)[n]1ccc(cc1)C(C)(C)C
• Title of publication: Octahedral HSiCl3 and HSiCl2Me Adducts with Pyridines
• Authors of publication: Gerrit W. Fester; Jörg Wagler; Erica Brendler; Uwe Böhme; Daniela Gerlach; Edwin Kroke
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 6855 - 6864
• a: 8.5932 ± 0.0003 Å
• b: 13.5318 ± 0.0004 Å
• c: 17.3502 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2017.51 ± 0.12 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0585
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.1083
• Weighted residual factors for all reflections included in the refinement: 0.1204
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No