Information card for entry 1576194

Structure parameters

• Formula: C30 H25 N O5
• Calculated formula: C30 H25 N O5
• Title of publication: Cu-Catalyzed Enantioconvergent Oxygen-Centered Radical Cyclization
• Authors of publication: Li, Zhen-Yu; Huang, Chun-Dong; Guan, Chun-Yan; Guo, Hui-Min; Liu, Ling-Min; Xiao, Xiao; Gao, Beiling; Ni, Shaofei; Mei, Guang-Jian
• Journal of publication: Chemical Science
• Year of publication: 2025
• a: 9.8748 ± 0.0002 Å
• b: 7.8411 ± 0.0002 Å
• c: 32.5589 ± 0.0006 Å
• α: 90°
• β: 92.1684 ± 0.0019°
• γ: 90°
• Cell volume: 2519.21 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0645
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1501
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No