Information card for entry 4130089

Structure parameters

• Formula: C26 H28 Si
• Calculated formula: C26 H28 Si
• SMILES: c12ccccc1C(=C1[Si](C3=C(c4ccccc4C3=C21)C)(C(C)C)C(C)C)C
• Title of publication: Rhodium-Catalyzed Stitching Reaction: Convergent Synthesis of Quinoidal Fused Oligosiloles.
• Authors of publication: Shintani, Ryo; Iino, Ryo; Nozaki, Kyoko
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 11
• Pages of publication: 3635 - 3638
• a: 8.4888 ± 0.0016 Å
• b: 14.564 ± 0.003 Å
• c: 17.222 ± 0.003 Å
• α: 90°
• β: 95.98 ± 0.003°
• γ: 90°
• Cell volume: 2117.6 ± 0.7 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 3
• 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: 0.0413
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0963
• Weighted residual factors for all reflections included in the refinement: 0.0977
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No