Information card for entry 2240305

Structure parameters

• Chemical name: Dioxidobis(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')[1-phenyl-3-(pyridin-4-yl)propane-κ<i>N</i>]uranium(VI)
• Formula: C24 H29 N O6 U
• Calculated formula: C24 H29 N O6 U
• SMILES: [U]12(=O)(=O)(OC(=CC(=[O]1)C)C)([O]=C(C)C=C(O2)C)[n]1ccc(cc1)CCCc1ccccc1
• Title of publication: Crystal structure of dioxidobis(pentane-2,4-dionato-κ^2^<i>O</i>,<i>O</i>')[1-phenyl-3-(pyridin-4-yl)propane-κ<i>N</i>]uranium(VI)
• Authors of publication: Kawasaki, Takeshi; Kitazawa, Takafumi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 1
• Pages of publication: 42 - 44
• a: 8.21 ± 0.0016 Å
• b: 11.53 ± 0.002 Å
• c: 14.516 ± 0.003 Å
• α: 108.67 ± 0.03°
• β: 98.5 ± 0.03°
• γ: 100.81 ± 0.03°
• Cell volume: 1246.4 ± 0.5 ų
• Cell temperature: 297 K
• Ambient diffraction temperature: 297 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes