Information card for entry 2206851

Structure parameters

• Chemical name: Bis(acetato)diaquadioxouranium(VI) acetic acid disolvate
• Formula: C8 H18 O12 U
• Calculated formula: C8 H18 O12 U
• SMILES: [U]12(=O)([OH2])(=O)(OC(=[O]1)C)([OH2])OC(=[O]2)C.O=C(C)O.C(=O)(C)O
• Title of publication: Diacetatodiaquadioxouranium(VI) acetic acid disolvate
• Authors of publication: Grigoriev, Mikhail S.; Antipin, Mikhail Yu.; Krot, Nikolai N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: m2078 - m2079
• a: 6.914 ± 0.002 Å
• b: 7.822 ± 0.002 Å
• c: 8.211 ± 0.002 Å
• α: 95 ± 0.02°
• β: 113.74 ± 0.02°
• γ: 99.79 ± 0.02°
• Cell volume: 394.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes