Information card for entry 7111279

Structure parameters

• Formula: C8 H28 N2 O42 S7 U6
• Calculated formula: C8 H24 N2 O42 S7 U6
• Title of publication: [NC4H12]2[(UO2)6(H2O)2(SO4)7]: the first organically templated actinide sulfate with a three-dimensional framework structure
• Authors of publication: Doran, Michael; Norquist, Alexander J.; O'Hare, Dermot
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 24
• Pages of publication: 2946 - 2947
• a: 10.3466 ± 0.0002 Å
• b: 18.5415 ± 0.0003 Å
• c: 22.7001 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4354.82 ± 0.13 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0377
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.076
• Weighted residual factors for all reflections included in the refinement: 0.0783
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No