Information card for entry 7108191

Structure parameters

• Formula: C16 H17 N Si
• Calculated formula: C16 H17 N Si
• SMILES: C[Si](C)(c1c2c3c(cccn3)ccc2ccc1)C
• Title of publication: Synthesis of benzo[h]quinoline-based neutral pentacoordinate organosilicon complexes
• Authors of publication: Yuichiro Tokoro; Hyeonuk Yeo; Kazuo Tanaka; Yoshiki Chujo
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 8541
• a: 9.2798 ± 0.0006 Å
• b: 6.9773 ± 0.0005 Å
• c: 10.569 ± 0.0008 Å
• α: 90°
• β: 94.586 ± 0.003°
• γ: 90°
• Cell volume: 682.13 ± 0.08 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.1113
• Weighted residual factors for all reflections included in the refinement: 0.117
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No