Information card for entry 1575194

Structure parameters

• Formula: C29 H21 N O8 S3
• Calculated formula: C29 H21 N O8 S3
• Title of publication: A pair of strongly reductive and oxidative photocatalysts for the general upcycling of biomass derivatives and plastic wastes.
• Authors of publication: Cui, Hao; Chen, Xiang; She, Xiong; Su, Wen-Xin; Chen, Shi-Chao; Zhang, Xiao
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 35
• Pages of publication: 16070 - 16080
• a: 14.4269 ± 0.0008 Å
• b: 18.7578 ± 0.001 Å
• c: 10.6226 ± 0.0005 Å
• α: 90°
• β: 108.077 ± 0.006°
• γ: 90°
• Cell volume: 2732.8 ± 0.3 ų
• Cell temperature: 299.79 ± 0.1 K
• Ambient diffraction temperature: 299.79 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.1046
• Residual factor for significantly intense reflections: 0.0779
• Weighted residual factors for significantly intense reflections: 0.1993
• Weighted residual factors for all reflections included in the refinement: 0.2163
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No