Information card for entry 7130396

Structure parameters

• Common name: Uranyl 2,6-bis(pyrazol-1-yl)pyridine-4-carboxylate
• Formula: C13 H13.5 N5.5 O5.5 U
• Calculated formula: C13 H13.5 N5.5 O5.5 U
• Title of publication: Enhancing photosensitivity via assembly of a uranyl coordination polymer
• Authors of publication: Xu, Miaomiao; Lu, Huangjie; Wang, Chunhui; Qiu, Jie; Zheng, Zhaofa; Guo, Xiaofeng; Zhang, Zhi-Hui; He, Mingyang; Qian, Junfeng; Lin, Jian
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 20.813 ± 0.002 Å
• b: 4.3839 ± 0.0003 Å
• c: 17.693 ± 0.002 Å
• α: 90°
• β: 93.952 ± 0.01°
• γ: 90°
• Cell volume: 1610.5 ± 0.3 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 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: 0.0753
• Residual factor for significantly intense reflections: 0.0605
• Weighted residual factors for significantly intense reflections: 0.1434
• Weighted residual factors for all reflections included in the refinement: 0.1578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No