Information card for entry 7703100

Structure parameters

• Formula: C44 H52 Cu N6 O18 U2
• Calculated formula: C44 H52 Cu N6 O18 U2
• Title of publication: Zero-, mono- and diperiodic uranyl ion complexes with the diphenate dianion: influences of transition metal ion coordination and differential U^VI chelation.
• Authors of publication: Thuéry, Pierre; Atoini, Youssef; Harrowfield, Jack
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 817 - 828
• a: 9.4464 ± 0.0008 Å
• b: 9.6422 ± 0.001 Å
• c: 15.019 ± 0.0012 Å
• α: 82.508 ± 0.005°
• β: 73.613 ± 0.005°
• γ: 67.945 ± 0.004°
• Cell volume: 1215.92 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No