Information card for entry 7123396

Structure parameters

• Formula: C19 H17 N O3
• Calculated formula: C19 H17 N O3
• Title of publication: Copper-Catalyzed Enantioselective Mukaiyama aldol Reaction of Silyl Enol Ethers with Isatins
• Authors of publication: Li, Jindong; Li, Yanan; Sun, Jianan; Gui, Yang; Huang, Yekai; Zha, Zhenggen; Wang, Zhiyong
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 9.7231 ± 0.0001 Å
• b: 5.8962 ± 0.0001 Å
• c: 13.7204 ± 0.0002 Å
• α: 90°
• β: 99.675 ± 0.001°
• γ: 90°
• Cell volume: 775.394 ± 0.019 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0336
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0875
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No