Information card for entry 4517851

Structure parameters

• Formula: C25 H23 F N2 O
• Calculated formula: C25 H23 F N2 O
• Title of publication: Light-Mediated Chiral Phosphate Catalysis for Asymmetric Dicarbofunctionalization of Enamides
• Authors of publication: Shen, Yang; Shen, Meng-Lan; Wang, Pu-Sheng
• Journal of publication: ACS Catalysis
• Year of publication: 2020
• Pages of publication: 8247 - 8253
• a: 9.2261 ± 0.0003 Å
• b: 9.7377 ± 0.0004 Å
• c: 22.6198 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2032.19 ± 0.13 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 169.98 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: 0.0427
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0925
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No