Information card for entry 7109633

Structure parameters

• Formula: C14 H23 F3 N O3 S
• Calculated formula: C14 H24 F3 N O3 S
• Title of publication: Lewis acid-catalyzed regioselective synthesis of chiral alpha-fluoroalkyl amines via asymmetric addition of silyl dienolates to fluorinated sulfinylimines
• Authors of publication: Yingle Liu; Jiawang Liu; Yangen Huang; Feng-Ling Qing
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 7492
• a: 9.405 ± 0.0012 Å
• b: 9.9217 ± 0.0012 Å
• c: 10.9244 ± 0.0014 Å
• α: 90°
• β: 113.544 ± 0.002°
• γ: 90°
• Cell volume: 934.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.1121
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No