Information card for entry 2229930

Structure parameters

• Chemical name: Dibromidobis(pyridine-3-carbonitrile-κ<i>N</i>^1^)mercury(II)
• Formula: C12 H8 Br2 Hg N4
• Calculated formula: C12 H8 Br2 Hg N4
• SMILES: c1ccc(C#N)c[n]1[Hg](Br)(Br)[n]1cccc(C#N)c1
• Title of publication: Dibromidobis(pyridine-3-carbonitrile-κ<i>N</i>^1^)mercury(II)
• Authors of publication: Ghiasi, Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: m595
• a: 8.5823 ± 0.0006 Å
• b: 9.4069 ± 0.0006 Å
• c: 9.8562 ± 0.0007 Å
• α: 81.935 ± 0.005°
• β: 71.435 ± 0.006°
• γ: 80.508 ± 0.006°
• Cell volume: 740.7 ± 0.09 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0332
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for all reflections included in the refinement: 0.0842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes