Information card for entry 7013357

Structure parameters

• Formula: C5.33 H5.33 O9.33 U1.33
• Calculated formula: C5.33333 H5.33333 O9.33333 U1.33333
• Title of publication: Incorporation of uranium(vi) into metal?organic framework solids, [UO2(C4H4O4)]�H2O, [UO2F(C5H6O4)]�2H2O, and [(UO2)1.5(C8H4O4)2]2[(CH3)2NCOH2]�H2O
• Authors of publication: Kim, Jong-Young; Norquist, Alexander J.; O'Hare, Dermot
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 14
• Pages of publication: 2813
• a: 7.572 ± 0.0005 Å
• b: 10.7786 ± 0.0008 Å
• c: 9.509 ± 0.0006 Å
• α: 90°
• β: 90.773 ± 0.005°
• γ: 90°
• Cell volume: 776.01 ± 0.09 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0689
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for all reflections: 0.0936
• Weighted residual factors for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8913
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No