Information card for entry 4029294

Structure parameters

• Formula: C19 H33 N O2 S Si2
• Calculated formula: C19 H33 N O2 S Si2
• SMILES: [C@@H](C#C[Si](C)(C)C)(NS(=O)(=O)c1ccc(cc1)C)[Si](C(C)(C)C)(C)C
• Title of publication: Enantioselective Synthesis of α-Silylamines by Meerwein-Ponndorf-Verley-Type Reduction of α-Silylimines by a Chiral Lithium Amide.
• Authors of publication: Kondo, Yasuhiro; Sasaki, Michiko; Kawahata, Masatoshi; Yamaguchi, Kentaro; Takeda, Kei
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2014
• Journal volume: 79
• Journal issue: 8
• Pages of publication: 3601 - 3609
• a: 10.368 ± 0.005 Å
• b: 10.478 ± 0.005 Å
• c: 21.015 ± 0.01 Å
• α: 88.133 ± 0.005°
• β: 89.305 ± 0.005°
• γ: 80.119 ± 0.005°
• Cell volume: 2247.9 ± 1.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1392
• Weighted residual factors for all reflections included in the refinement: 0.1419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No