Information card for entry 4348397

Structure parameters

• Formula: C18 H42 Mg O22 U2
• Calculated formula: C18 H42 Mg O22 U2
• SMILES: C1(=[O][U]23(=O)(=O)([O]=C(CC)O2)([O]=C(CC)O3)O1)CC.O=[U]123(=O)([O]=C(CC)O1)([O]=C(CC)O2)[O]=C(CC)O3.[Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2]
• Title of publication: Synthesis and X-ray Crystallography of [Mg(H2O)6][AnO2(C2H5COO)3]2 (An = U, Np, or Pu).
• Authors of publication: Serezhkin, Viktor N.; Grigoriev, Mikhail S.; Abdulmyanov, Aleksey R.; Fedoseev, Aleksandr M.; Savchenkov, Anton V.; Serezhkina, Larisa B.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 15
• Pages of publication: 7688 - 7693
• a: 21.0268 ± 0.0003 Å
• b: 21.0268 ± 0.0003 Å
• c: 26.4214 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 10116.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0245
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0325
• Weighted residual factors for all reflections included in the refinement: 0.0336
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No