Information card for entry 4315128

Structure parameters

• Chemical name: phenyltrichlorosilane 1,10-phenanthroline complex
• Formula: C18 H13 Cl3 N2 Si
• Calculated formula: C18 H13 Cl3 N2 Si
• SMILES: Cl[Si]1(Cl)(Cl)([n]2cccc3ccc4ccc[n]1c4c23)c1ccccc1
• Title of publication: Reactions of Hydridochlorosilanes with 2,2'-Bipyridine and 1,10-Phenanthroline: Complexation versus Dismutation and Metal-Catalyst-Free 1,4-Hydrosilylation
• Authors of publication: Gerrit W. Fester; Jana Eckstein; Daniela Gerlach; Jörg Wagler; Erica Brendler; Edwin Kroke
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2667 - 2673
• a: 8.8765 ± 0.0004 Å
• b: 13.2802 ± 0.0005 Å
• c: 14.3927 ± 0.0006 Å
• α: 90°
• β: 104.071 ± 0.002°
• γ: 90°
• Cell volume: 1645.73 ± 0.12 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 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: 0.046
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No