Information card for entry 2229388

Structure parameters

• Chemical name: Di-μ-chlorido-bis{chlorido[4-nitro-<i>N</i>-(pyridin-2-ylmethylidene- κ<i>N</i>)aniline-κ<i>N</i>]mercury(II)}
• Formula: C24 H18 Cl4 Hg2 N6 O4
• Calculated formula: C24 H18 Cl4 Hg2 N6 O4
• SMILES: c1cccc2[n]1[Hg]1([N](c3ccc(cc3)N(=O)=O)=C2)(Cl)[Cl][Hg]2([n]3ccccc3C=[N]2c2ccc(N(=O)=O)cc2)(Cl)[Cl]1
• Title of publication: Di-μ-chlorido-bis{chlorido[4-nitro-<i>N</i>-(pyridin-2-ylmethylidene-κ<i>N</i>)aniline-κ<i>N</i>]mercury(II)}
• Authors of publication: Salehzadeh, Sadegh; Dehghanpour, Saeed; Khalaj, Mehdi; Rahimishakiba, Mohammad
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 3
• Pages of publication: m327
• a: 8.9731 ± 0.0002 Å
• b: 7.8439 ± 0.0003 Å
• c: 20.1403 ± 0.0007 Å
• α: 90°
• β: 98.155 ± 0.002°
• γ: 90°
• Cell volume: 1403.22 ± 0.08 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• 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: 0.0399
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections included in the refinement: 0.0637
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes