Information card for entry 2240609

Structure parameters

• Chemical name: Bis(2-amino-5-chloropyridinium) tetrachloridocobaltate(II)
• Formula: C10 H12 Cl6 Co N4
• Calculated formula: C10 H12 Cl6 Co N4
• SMILES: [Co](Cl)(Cl)([Cl-])[Cl-].Clc1ccc(N)[nH+]c1.Clc1ccc([nH+]c1)N
• Title of publication: Crystal structure of bis(2-amino-5-chloropyridinium) tetrachloridocobaltate(II)
• Authors of publication: Mghandef, Marwa; Boughzala, Habib
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 5
• Pages of publication: 555 - 557
• a: 13.519 ± 0.002 Å
• b: 14.945 ± 0.003 Å
• c: 8.725 ± 0.002 Å
• α: 90°
• β: 92.858 ± 0.003°
• γ: 90°
• Cell volume: 1760.6 ± 0.6 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: 0.1034
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0909
• Weighted residual factors for all reflections included in the refinement: 0.1091
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes