Information card for entry 7122364

Structure parameters

• Chemical name: UO2 4 tOct Ph
• Formula: C42 H49 N2 O5 U
• Calculated formula: C42 H49 N2 O5 U
• Title of publication: Expanded Campestarene Hosts for Tetra- and Dinuclear Uranyl(VI) Complexes
• Authors of publication: Chaudhry, Mohammad; Lelj, Francesco; MacLachlan, Mark
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 29.7978 ± 0.0013 Å
• b: 29.7978 ± 0.0013 Å
• c: 21.0965 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 18731.8 ± 1.5 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0898
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1479
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No