Information card for entry 8103336

Structure parameters

• Formula: C10 H14 Co N4 O12
• Calculated formula: C10 H14 Co N4 O12
• Title of publication: Crystal structure of diaquabis(2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato-k2O,O')cobalt(II) dihydrate, Co(C5H3N2O4)2(H2O)2 · 2H2O
• Authors of publication: Bo Xiao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2012
• Journal volume: 227
• Journal issue: 2
• Pages of publication: 161
• a: 5.0091 ± 0.0012 Å
• b: 8.1296 ± 0.0018 Å
• c: 9.55 ± 0.002 Å
• α: 74.444 ± 0.018°
• β: 84.718 ± 0.018°
• γ: 88.887 ± 0.019°
• Cell volume: 373.05 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0802
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1436
• Weighted residual factors for all reflections included in the refinement: 0.1577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No