Information card for entry 4117895

Structure parameters

• Formula: C26 H24 Si
• Calculated formula: C26 H24 Si
• SMILES: [Si@]1(c2c(ccc3ccccc23)c2c1cccc2)(C(C)(C)C)c1ccccc1
• Title of publication: Palladium-Catalyzed Asymmetric Synthesis of Silicon-Stereogenic Dibenzosiloles via Enantioselective C-H Bond Functionalization
• Authors of publication: Shintani, Ryo; Otomo, Haruka; Ota, Kensuke; Hayashi, Tamio
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Journal issue: 17
• Pages of publication: 7305 - 7308
• a: 11.2001 ± 0.0003 Å
• b: 7.35727 ± 0.00017 Å
• c: 24.4176 ± 0.0005 Å
• α: 90°
• β: 99.6203 ± 0.0017°
• γ: 90°
• Cell volume: 1983.77 ± 0.08 ų
• Cell temperature: 93.1 K
• Ambient diffraction temperature: 93 ± 1 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for all reflections included in the refinement: 0.0725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No