Information card for entry 1506545

Structure parameters

• Chemical name: (R(S),R)-1-dimethylphenyl-2,2-dimethylpropyl)-t-butanesulfinamide
• Formula: C17 H33 N O2 S Si
• Calculated formula: C17 H33 N O2 S Si
• SMILES: c1(ccccc1)[Si]([C@H](C(C)(C)C)NS(C(C)(C)C)=O)(C)C.O
• Title of publication: Stereoselective synthesis of alpha-silylamines by the direct addition of silyl anions to activated imines.
• Authors of publication: Ballweg, David M.; Miller, Rebecca C.; Gray, Danielle L.; Scheidt, Karl A.
• Journal of publication: Organic letters
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 7
• Pages of publication: 1403 - 1406
• a: 6.5692 ± 0.0013 Å
• b: 15.207 ± 0.003 Å
• c: 20.303 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2028.2 ± 0.7 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• 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: 0.147
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.1058
• Weighted residual factors for all reflections included in the refinement: 0.1279
• Goodness-of-fit parameter for all reflections included in the refinement: 0.877
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No