Information card for entry 7252152

Structure parameters

• Formula: C64 H32 O10 Zn3
• Calculated formula: C64 H32 O10 Zn3
• Title of publication: A visible-light-responsive metal–organic framework for highly efficient and selective photocatalytic oxidation of amines and reduction of nitroaromatics
• Authors of publication: Chen, Peiqi; Guo, Zhifen; Liu, Xin; Lv, Hui; Che, Yan; Bai, Rong; Chi, Yanhong; Xing, Hongzhu
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 47
• Pages of publication: 27074 - 27080
• a: 37.121 ± 0.003 Å
• b: 30.255 ± 0.003 Å
• c: 6.0011 ± 0.0005 Å
• α: 90°
• β: 94.396 ± 0.003°
• γ: 90°
• Cell volume: 6720 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0867
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1477
• Weighted residual factors for all reflections included in the refinement: 0.1675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No