Information card for entry 2224798

Structure parameters

• Chemical name: Poly[[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)(μ~3~-pyrazine-2,3- dicarboxylato-κ^4^<i>N</i>^1^,O^2^:<i>O</i>^3^:<i>O</i>^3^)copper(II)] monohydrate]
• Formula: C9 H11 Cu N3 O6
• Calculated formula: C9 H11 Cu N3 O6
• Title of publication: Poly[[(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)(μ~3~-pyrazine-2,3-dicarboxylato-κ^4^<i>N</i>^1^,O^2^:<i>O</i>^3^:<i>O</i>^3^)copper(II)] monohydrate]
• Authors of publication: Fan, Zhen-Zhong; Wang, Guo-Ping; Li, Yu-Sheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: m10 - m11
• a: 10.1656 ± 0.0005 Å
• b: 13.631 ± 0.0008 Å
• c: 9.1461 ± 0.0002 Å
• α: 90°
• β: 91.43 ± 0.002°
• γ: 90°
• Cell volume: 1266.96 ± 0.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0759
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1054
• Weighted residual factors for all reflections included in the refinement: 0.115
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes