Information card for entry 2219334

Structure parameters

• Chemical name: (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato- κ^2^<i>O</i>^4^,<i>O</i>^5^)(4-oxido-2-oxo-1,2-dihydropyrimidine-5- carboxylato-κ^2^<i>O</i>^4^,<i>O</i>^5^)bis(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')yttrium(III) dihydrate
• Formula: C34 H25 N8 O10 Y
• Calculated formula: C34 H25 N8 O10 Y
• Title of publication: (2,4-Dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-κ^2^<i>O</i>^4^,<i>O</i>^5^)(4-oxido-2-oxo-1,2-dihydropyrimidine-5-carboxylato-κ^2^<i>O</i>^4^,<i>O</i>^5^)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')yttrium(III) dihydrate
• Authors of publication: Xiong, Wei; Xing, Huihui; Su, Yan; Chen, Zilu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: m1166 - m1167
• a: 17.174 ± 0.0013 Å
• b: 14.4385 ± 0.0011 Å
• c: 13.2365 ± 0.001 Å
• α: 90°
• β: 100.881 ± 0.001°
• γ: 90°
• Cell volume: 3223.2 ± 0.4 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 1.213
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes