Information card for entry 7224898

Structure parameters

• Formula: C21 H22 N2 O6 U
• Calculated formula: C21 H22 N2 O6 U
• Title of publication: Anchoring flexible uranyl dicarboxylate chains through stacking interactions of ancillary ligands on chiral U(vi) centres
• Authors of publication: Thuéry, Pierre; Harrowfield, Jack
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 21
• Pages of publication: 3905
• a: 8.9926 ± 0.0005 Å
• b: 10.1782 ± 0.0006 Å
• c: 12.334 ± 0.0008 Å
• α: 74.294 ± 0.003°
• β: 69.809 ± 0.004°
• γ: 75.184 ± 0.004°
• Cell volume: 1003.39 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0309
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0549
• Weighted residual factors for all reflections included in the refinement: 0.0563
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No