Information card for entry 2233501

Structure parameters

• Chemical name: Poly[aqua[μ~3~-4-carboxy-2-(pyridin-4-yl)-1<i>H</i>-imidazole-5-carboxylato- κ^5^<i>N</i>^1^,<i>O</i>^5^:<i>N</i>^3^,<i>O</i>^4^:<i>N</i>^2^]nickel(II)]
• Formula: C10 H7 N3 Ni O5
• Calculated formula: C10 H7 N3 Ni O5
• Title of publication: Poly[aqua[μ~3~-4-carboxy-2-(pyridin-4-yl)-1<i>H</i>-imidazole-5-carboxylato-κ^5^<i>N</i>^1^,<i>O</i>^5^:<i>N</i>^3^,<i>O</i>^4^:<i>N</i>^2^]nickel(II)]
• Authors of publication: Jing, Xue-Min; Gong, Shu-zhe; Xiao, Li-Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 2
• Pages of publication: m187
• a: 7.5117 ± 0.0015 Å
• b: 11.4 ± 0.002 Å
• c: 12.896 ± 0.004 Å
• α: 90°
• β: 109.04 ± 0.03°
• γ: 90°
• Cell volume: 1043.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0656
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1116
• Weighted residual factors for all reflections included in the refinement: 0.1179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes