Information card for entry 2203897

Structure parameters

• Formula: C4 H19 N2 O19 S3 U2
• Calculated formula: C4 H19 N2 O19 S3 U2
• Title of publication: (C~8~H~26~N~4~)~0.5~[(UO~2~)~2~(SO~4~)~3~(H~2~O)]·2H~2~O, an organically templated uranyl sulfate with a novel layer type
• Authors of publication: Doran, Michael B.; Norquist, Alexander J.; Stuart, Clair L.; O'Hare, Dermot
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 7
• Pages of publication: m996 - m998
• a: 11.84 ± 0.0002 Å
• b: 10.319 ± 0.0002 Å
• c: 16.5919 ± 0.0004 Å
• α: 90°
• β: 107.772 ± 0.0009°
• γ: 90°
• Cell volume: 1930.41 ± 0.07 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• 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: 0.0356
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for all reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.0552
• Weighted residual factors for all reflections included in the refinement: 0.0552
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9792
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes