Information card for entry 4316567

Structure parameters

• Formula: C12 H40 N4 O41 U6
• Calculated formula: C12 O32 U6
• Title of publication: Capturing Hydrolysis Products in the Solid State: Effects of pH on Uranyl Squarates under Ambient Conditions
• Authors of publication: Clare E. Rowland; Christopher L. Cahill
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 8668 - 8673
• a: 16.6897 ± 0.0007 Å
• b: 16.6897 ± 0.0007 Å
• c: 16.6897 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4648.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 197
• Hermann-Mauguin space group symbol: I 2 3
• Hall space group symbol: I 2 2 3
• Residual factor for all reflections: 0.024
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.239
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No