Information card for entry 7718321

Structure parameters

• Formula: C165 H302 N44 O54 U2
• Calculated formula: C51 H36 N6 O16 U2
• Title of publication: A uranyl-based metal-organic framework featuring an eight-connected U₄L₂ cage for guest capture.
• Authors of publication: Deng, Shuang; Huang, Zhi-Wei; Fu, Xuan; Zhou, Zhi-Heng; Guo, Zhi-Ren; Mei, Lei; Yu, Ji-Pan; Zhu, Yan-Qiu; Wang, Nan-Nan; Hu, Kong-Qiu; Shi, Wei-Qun
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 15
• Pages of publication: 6239 - 6245
• a: 39.072 ± 0.002 Å
• b: 39.072 ± 0.002 Å
• c: 28.851 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 44045 ± 6 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 K
• Number of distinct elements: 5
• Space group number: 138
• Hermann-Mauguin space group symbol: P 42/n c m :2
• Hall space group symbol: -P 4ac 2ac
• Residual factor for all reflections: 0.1099
• Residual factor for significantly intense reflections: 0.0764
• Weighted residual factors for significantly intense reflections: 0.2262
• Weighted residual factors for all reflections included in the refinement: 0.2617
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No