Information card for entry 2234845

Structure parameters

• Chemical name: Dichloridobis(pyrazine-2-carboxamide-κ<i>N</i>^4^)zinc(II)
• Formula: C10 H10 Cl2 N6 O2 Zn
• Calculated formula: C10 H10 Cl2 N6 O2 Zn
• SMILES: c1c(C(=O)N)ncc[n]1[Zn]([n]1cc(C(=O)N)ncc1)(Cl)Cl
• Title of publication: Dichloridobis(pyrazine-2-carboxamide-κ<i>N</i>^4^)zinc(II)
• Authors of publication: Shirvan, Sadif A.; Haydari Dezfuli, Sara
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m546
• a: 5.4296 ± 0.0005 Å
• b: 19.7629 ± 0.0014 Å
• c: 6.8396 ± 0.0005 Å
• α: 90°
• β: 105.131 ± 0.007°
• γ: 90°
• Cell volume: 708.48 ± 0.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0708
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.0869
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes