Information card for entry 7113975

Structure parameters

• Formula: C22 H20 Si
• Calculated formula: C23 H22 Si
• SMILES: C1c2ccccc2C(=C(c2ccccc2)[Si]1(C)C)c1ccccc1
• Title of publication: Silylium ion-promoted dehydrogenative cyclization: synthesis of silicon-containing compounds derived from alkynes
• Authors of publication: Hidekazu Arii; Takashi Kurihara; Kunio Mochida; Takayuki Kawashima
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 6649
• a: 9.7459 ± 0.001 Å
• b: 10.4452 ± 0.0011 Å
• c: 18.2147 ± 0.0019 Å
• α: 90°
• β: 99.69 ± 0.001°
• γ: 90°
• Cell volume: 1827.8 ± 0.3 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 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: 0.0414
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.0764
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No