Information card for entry 4349414

Structure parameters

• Formula: C8 H20 B I6 N Si
• Calculated formula: C8 H20 B I6 N Si
• SMILES: [Si]([B](I)(I)I)(I)(I)I.[N+](CC)(CC)(CC)CC
• Title of publication: Trapping Experiments on a Trichlorosilanide Anion: a Key Intermediate of Halogenosilane Chemistry.
• Authors of publication: Teichmann, Julian; Bursch, Markus; Köstler, Benedikt; Bolte, Michael; Lerner, Hans-Wolfram; Grimme, Stefan; Wagner, Matthias
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 15
• Pages of publication: 8683 - 8688
• a: 12.3344 ± 0.0005 Å
• b: 12.9838 ± 0.0006 Å
• c: 13.302 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2130.28 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0231
• Residual factor for significantly intense reflections: 0.0209
• Weighted residual factors for significantly intense reflections: 0.0427
• Weighted residual factors for all reflections included in the refinement: 0.0432
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No