Information card for entry 2202739

Structure parameters

• Formula: C5 H16 N2 O11 S2 U
• Calculated formula: C5 H16 N2 O11 S2 U
• SMILES: [U]1(=O)(=O)([OH2])OS(=O)(=O)O[U](=O)(=O)([OH2])(OS(=O)(=O)[O-])(OS(=O)(=O)[O-])OS(=O)(=O)O1.[NH+]1(CC[NH2+]CC1)C.[NH+]1(CC[NH2+]CC1)C
• Title of publication: <i>catena</i>-Poly[1-methylpiperazinium [[aquadioxouranium(VI)]-di-μ-sulfato-κ^4^<i>O</i>:<i>O</i>']]
• Authors of publication: Stuart, Clair L.; Doran, Michael B.; Norquist, Alexander J.; O'Hare, Dermot
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 7
• Pages of publication: m446 - m448
• a: 8.0031 ± 0.0002 Å
• b: 8.1873 ± 0.0002 Å
• c: 10.8911 ± 0.0003 Å
• α: 72.704 ± 0.001°
• β: 81.7766 ± 0.0011°
• γ: 78.7917 ± 0.0009°
• Cell volume: 665.59 ± 0.03 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0212
• Weighted residual factors for all reflections included in the refinement: 0.0535
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No