Information card for entry 7057014

Structure parameters

• Formula: C10 H18 N2 O7 U
• Calculated formula: C10 H18 N2 O7 U
• SMILES: [U]12(ON3C(=[O]1)CCCC3)(=O)(ON1CCCCC1=[O]2)(=O)[OH2]
• Title of publication: Effects of preorganization in the chelation of UO22+by hydroxamate ligands: cyclic PIPO−vs.linear NMA−
• Authors of publication: Sornosa-Ten, Alejandra; Jewula, Pawel; Fodor, Tamas; Brandès, Stéphane; Sladkov, Vladimir; Rousselin, Yoann; Stern, Christine; Chambron, Jean-Claude; Meyer, Michel
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 10
• Pages of publication: 7765
• a: 6.472 ± 0.003 Å
• b: 27.71 ± 0.011 Å
• c: 8.31 ± 0.003 Å
• α: 90°
• β: 110.61 ± 0.009°
• γ: 90°
• Cell volume: 1394.9 ± 1 ų
• Cell temperature: 115 ± 1 K
• Ambient diffraction temperature: 115 ± 1 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: 0.0284
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.06
• Goodness-of-fit parameter for all reflections included in the refinement: 1.309
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No