Information card for entry 7120223

Structure parameters

• Formula: C16 H27 Cl N2 Si
• Calculated formula: C16 H27 Cl N2 Si
• SMILES: Cl[SiH]1([N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C)C
• Title of publication: Metal free mild and selective aldehyde cyanosilylation by a neutral penta-coordinate silicon compound
• Authors of publication: Swamy, V.S.V.S.N.; Bisai, Milan Kumar; Das, Tamal; Sen, Sakya Singha
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 9.4858 ± 0.0018 Å
• b: 11.987 ± 0.002 Å
• c: 15.459 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1757.8 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0703
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.184
• Weighted residual factors for all reflections included in the refinement: 0.1896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No