Information card for entry 2017939

Structure parameters

• Chemical name: poly[(μ~3~-3-aminocarbonylpyrazine-2-carboxylato- κ^3^<i>N</i>^1^:<i>O</i>^2^:<i>O</i>^2'^)silver(I)]
• Formula: C6 H4 Ag N3 O3
• Calculated formula: C6 H4 Ag N3 O3
• SMILES: [Ag]1[n]2c(c(ncc2)C(=O)N)C(O[Ag]2[n]3c(c(ncc3)C(=O)N)C(=O)O1)=[O][Ag]1[n]3c(c(ncc3)C(=O)N)C(O[Ag][n]3c(c(ncc3)C(=O)N)C(=[O]2)O1)=[O]
• Title of publication: The coordination polymer poly[(μ~3~-3-aminocarbonylpyrazine-2-carboxylato-κ^3^<i>N</i>^1^:<i>O</i>^2^:<i>O</i>^2'^)silver(I)]
• Authors of publication: Massoud, Al-shima'a A.; Langer, Vratislav; Abu-Youssef, Morsy A. M.; Öhrström, Lars
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 1
• Pages of publication: m1 - m4
• a: 5.054 ± 0.0002 Å
• b: 6.2507 ± 0.0002 Å
• c: 10.9778 ± 0.0002 Å
• α: 85.57 ± 0.001°
• β: 88.638 ± 0.001°
• γ: 84.509 ± 0.002°
• Cell volume: 344.131 ± 0.019 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0787
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.0801
• Weighted residual factors for all reflections included in the refinement: 0.0909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes