Information card for entry 4514621

Structure parameters

• Formula: C18 H16 N2 O3
• Calculated formula: C18 H16 N2 O3
• Title of publication: Access to Isoxazolidines through Visible-Light-Induced Difunctionalization of Alkenes
• Authors of publication: Yang, Hui; Wei, Guo; Jiang, Zhiyong
• Journal of publication: ACS Catalysis
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 10
• Pages of publication: 9599
• a: 11.4615 ± 0.0014 Å
• b: 5.5002 ± 0.0006 Å
• c: 12.6887 ± 0.0013 Å
• α: 90°
• β: 105.131 ± 0.012°
• γ: 90°
• Cell volume: 772.17 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.051
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No