Information card for entry 7032799

Structure parameters

• Formula: C32 H52 Fe2 Mg N4 O43 U2
• Calculated formula: C32 H52 Fe2 Mg N4 O43 U2
• Title of publication: Structural characterization of environmentally relevant ternary uranyl citrate complexes present in aqueous solutions and solid state materials.
• Authors of publication: Basile, Madeline; Unruh, Daniel K.; Flores, Erin; Johns, Adam; Forbes, Tori Z.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 6
• Pages of publication: 2597 - 2605
• a: 9.2106 ± 0.0006 Å
• b: 9.8799 ± 0.0007 Å
• c: 15.1866 ± 0.001 Å
• α: 84.12 ± 0.002°
• β: 88.101 ± 0.002°
• γ: 83.115 ± 0.002°
• Cell volume: 1364.49 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0429
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0836
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No