Information card for entry 2229922

Structure parameters

• Chemical name: Poly[aquabis(μ-formato-κ^2^<i>O</i>:<i>O</i>')(μ- pyrazine-κ^2^<i>N</i>:<i>N</i>')nickel(II)]
• Formula: C6 H8 N2 Ni O5
• Calculated formula: C6 H8 N2 Ni O5
• Title of publication: Poly[aquabis(μ-formato-κ^2^<i>O</i>:<i>O</i>')(μ-pyrazine-κ^2^<i>N</i>:<i>N</i>')nickel(II)]
• Authors of publication: Wöhlert, Susanne; Wriedt, Mario; Jess, Inke; Näther, Christian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: m532
• a: 7.8169 ± 0.0004 Å
• b: 7.0077 ± 0.0003 Å
• c: 15.6586 ± 0.0007 Å
• α: 90°
• β: 98.971 ± 0.004°
• γ: 90°
• Cell volume: 847.26 ± 0.07 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: 0.0291
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0567
• Weighted residual factors for all reflections included in the refinement: 0.0586
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes