Information card for entry 7244311

Structure parameters

• Formula: C32 H22 N4 O10 U Zn
• Calculated formula: C32 H22 N4 O10 U Zn
• Title of publication: Plumbing the uncertainties of solvothermal synthesis involving uranyl ion carboxylate complexes
• Authors of publication: Harrowfield, Jack; Atoini, Youssef; Thuéry, Pierre
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 12.0722 ± 0.0005 Å
• b: 8.0184 ± 0.0004 Å
• c: 16.9466 ± 0.0007 Å
• α: 90°
• β: 108.408 ± 0.0017°
• γ: 90°
• Cell volume: 1556.49 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0174
• Residual factor for significantly intense reflections: 0.0163
• Weighted residual factors for significantly intense reflections: 0.0401
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No