Information card for entry 2217069

Structure parameters

• Chemical name: Bis(2-benzoyl-1-phenylethenolato-κ^2^O,O')(ethanol-κO)dioxidouranium(VI)
• Formula: C32 H28 O7 U
• Calculated formula: C32 H28 O7 U
• SMILES: [U]12(=O)(=O)(OC(=CC(=[O]1)c1ccccc1)c1ccccc1)([O]=C(c1ccccc1)C=C(O2)c1ccccc1)[OH]CC
• Title of publication: Bis(2-benzoyl-1-phenylethenolato-κ^2^<i>O</i>,<i>O</i>')(ethanol-κ<i>O</i>)dioxidouranium(VI)
• Authors of publication: Takao, Koichiro; Ikeda, Yasuhisa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: m219 - m220
• a: 9.088 ± 0.005 Å
• b: 12.141 ± 0.007 Å
• c: 25.878 ± 0.013 Å
• α: 90°
• β: 99.126 ± 0.016°
• γ: 90°
• Cell volume: 2819 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0784
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0826
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes