Information card for entry 2013253

Structure parameters

• Formula: C32 H40 N2 O9 U
• Calculated formula: C32 H40 N2 O9 U
• SMILES: [U]12345(Oc6c(O)cccc6C=[N]1C(C[N]2=Cc1c(O3)c(O)ccc1)(C)C)(OC(C)=CC(=[O]4)C)OC(=CC(=[O]5)C)C.O1CCCC1
• Title of publication: A bis(acetylacetonato)uranium(IV) complex of the Schiff base <i>N</i>,<i>N</i>'-bis(3-hydroxysalicylidene)-2-methyl-1,2-propanediamine
• Authors of publication: Salmon, Lionel; Thuéry, Pierre; Ephritikhine, Michel
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 6
• Pages of publication: m246 - m248
• a: 11.9744 ± 0.0006 Å
• b: 15.7475 ± 0.0004 Å
• c: 16.733 ± 0.0008 Å
• α: 90°
• β: 91.249 ± 0.002°
• γ: 90°
• Cell volume: 3154.5 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0551
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0862
• Weighted residual factors for all reflections included in the refinement: 0.0923
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes