Information card for entry 4308128

Structure parameters

• Common name: sodium uranyl triperoxo hydrate
• Chemical name: sodium uranyl triperoxo hydrate
• Formula: H24 Na4 O20 U
• Calculated formula: Na4 O20 U
• SMILES: O1O[U]231(OO2)(=O)(OO3)=O.O.[Na+].O.[Na+].O.O.O.[Na+].O.O.[Na+].O.O.O.O.O
• Title of publication: Expanding the Crystal Chemistry of Uranyl Peroxides: Synthesis and Structures of Di- and Triperoxodioxouranium(VI) Complexes
• Authors of publication: Karrie-Ann Kubatko; Tori Z. Forbes; Amanda L. Klingensmith; Peter C. Burns
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3657 - 3662
• a: 6.7883 ± 0.0006 Å
• b: 16.0005 ± 0.0015 Å
• c: 16.5624 ± 0.0016 Å
• α: 90°
• β: 91.917 ± 0.002°
• γ: 90°
• Cell volume: 1797.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0392
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0666
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No