Information card for entry 7003837

Structure parameters

• Formula: C23 H30 N4 O10 U2
• Calculated formula: C23 H30 N4 O10 U2
• SMILES: [U]123([OH][U]45(=O)(=O)(Oc6c(C=[N]4CC([O]25)C[N]3=Cc2c(O1)cccc2)cccc6)[O]=CN(C)C)(=O)(=O)[O]=CN(C)C
• Title of publication: Hydroxy- and alkoxy-bridged dinuclear uranyl‒Schiff base complexes: hydrolysis, transamination and extraction studies
• Authors of publication: Bharara, Mohan S.; Heflin, Kathryn; Tonks, Stephen; Strawbridge, Kara L.; Gorden, Anne E. V.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 22
• Pages of publication: 2966 - 2973
• a: 11.797 ± 0.003 Å
• b: 9.784 ± 0.002 Å
• c: 24.594 ± 0.005 Å
• α: 90°
• β: 94.811 ± 0.004°
• γ: 90°
• Cell volume: 2828.7 ± 1.1 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• 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: 0.0364
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0539
• Weighted residual factors for all reflections included in the refinement: 0.0557
• Goodness-of-fit parameter for all reflections included in the refinement: 0.858
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No