Information card for entry 4334306

Structure parameters

• Formula: C12 H6.25 Eu2 N4 O10.125
• Calculated formula: C12 H4 Eu2 N4 O10.13
• Title of publication: Europium Pyrimidine-4,6-dicarboxylate Framework with a Single-Crystal-to-Single-Crystal Transition and a Reversible Dehydration/Rehydration Process
• Authors of publication: Hao-Ling Sun; Dan-Dan Yin; Qi Chen; Zhenqiang Wang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 3582 - 3584
• a: 7.5755 ± 0.0005 Å
• b: 15.6186 ± 0.0012 Å
• c: 16.6991 ± 0.0012 Å
• α: 90°
• β: 94.375 ± 0.001°
• γ: 90°
• Cell volume: 1970.1 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0368
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.0584
• Weighted residual factors for all reflections included in the refinement: 0.0616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No