Information card for entry 7708689

Structure parameters

• Formula: C83 H81 N2 O44 Zr6
• Calculated formula: C83 H57 N2 O32 Zr6
• Title of publication: Hydrangea-like architectures composed of Zr-based metal–organic framework nanosheets with enhanced iodine capture
• Authors of publication: Wang, Xiangxiang; Zhang, Hao; Qi, Chao; Zhou, Fan; Ni, Linhan; Chen, Saisai; Qi, Junwen; Wang, Chaohai; Zheng, Tao; Li, Jiansheng
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 30.976 ± 0.007 Å
• b: 30.976 ± 0.007 Å
• c: 24.946 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 23936 ± 9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 121
• Hermann-Mauguin space group symbol: I -4 2 m
• Hall space group symbol: I -4 2
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No