Information card for entry 4135387

Structure parameters

• Formula: C33 H23 N
• Calculated formula: C33 H23 N
• Title of publication: Discovery of Oxygen α-Nucleophilic Addition to α,β-Unsaturated Amides Catalyzed by Redox-Neutral Organic Photoreductant.
• Authors of publication: Luan, Zi-Hong; Qu, Jian-Ping; Kang, Yan-Biao
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• Journal volume: 142
• Journal issue: 50
• Pages of publication: 20942 - 20947
• a: 13.6755 ± 0.0007 Å
• b: 5.2979 ± 0.0003 Å
• c: 31.08 ± 0.0014 Å
• α: 90°
• β: 92.838 ± 0.005°
• γ: 90°
• Cell volume: 2249 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1346
• Residual factor for significantly intense reflections: 0.0719
• Weighted residual factors for significantly intense reflections: 0.1394
• Weighted residual factors for all reflections included in the refinement: 0.1787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No