Information card for entry 7239763

Structure parameters

• Formula: C27 H25 Cl O4
• Calculated formula: C27 H25 Cl O4
• Title of publication: Catalytic O‒H bond insertion reactions using surface modified sewage sludge as a catalyst
• Authors of publication: Zhang, Zhipeng; Yu, Yang; Huang, Fei; Yi, Xiangyan; Xu, Yao; He, Yide; Baell, Jonathan B.; Huang, He
• Journal of publication: Green Chemistry
• Year of publication: 2020
• Journal volume: 22
• Journal issue: 5
• Pages of publication: 1594 - 1604
• a: 8.4738 ± 0.0002 Å
• b: 24.4748 ± 0.0006 Å
• c: 11.8708 ± 0.0003 Å
• α: 90°
• β: 91.051 ± 0.001°
• γ: 90°
• Cell volume: 2461.53 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.09
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1953
• Weighted residual factors for all reflections included in the refinement: 0.2209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No