Information card for entry 2210051

Structure parameters

• Chemical name: triaqua(4-hydroxypyridine-2,6-dicarboxylato)nickel(II) sesquihydrate,
• Formula: C7 H12 N Ni O9.5
• Calculated formula: C7 H12 N Ni O9.5
• Title of publication: Triaqua(4-hydroxypyridine-2,6-dicarboxylato)nickel(II) sesquihydrate
• Authors of publication: Jian-Zhong Cui; Hong Zhang; Yu-Quan Shi; Bin Chen; Hong-Ling Gao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2057 - m2058
• a: 14.879 ± 0.002 Å
• b: 6.9505 ± 0.0014 Å
• c: 22.567 ± 0.003 Å
• α: 90°
• β: 90.474 ± 0.009°
• γ: 90°
• Cell volume: 2333.7 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0834
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.1518
• Weighted residual factors for all reflections included in the refinement: 0.1574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.228
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes