Information card for entry 2222813

Structure parameters

• Chemical name: Bis[μ~2~-1,2-bis(imidazol-1-ylmethyl)benzene- κ^2^<i>N</i>^3^:<i>N</i>^3'^)]bis[dichloridozinc(II)]
• Formula: C28 H28 Cl4 N8 Zn2
• Calculated formula: C28 H28 Cl4 N8 Zn2
• SMILES: c12Cn3c[n](cc3)[Zn](Cl)([n]3cn(Cc4c(Cn5c[n](cc5)[Zn]([n]5cn(Cc1cccc2)cc5)(Cl)Cl)cccc4)cc3)Cl
• Title of publication: Bis[μ~2~-1,2-bis(imidazol-1-ylmethyl)benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^]bis[dichloridozinc(II)]
• Authors of publication: Hu, Meihong; Zhang, Shishen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: m970
• a: 8.5502 ± 0.0012 Å
• b: 8.7267 ± 0.0013 Å
• c: 11.5726 ± 0.0017 Å
• α: 102.824 ± 0.002°
• β: 105.72 ± 0.002°
• γ: 91.763 ± 0.002°
• Cell volume: 806.7 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0377
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.0819
• Weighted residual factors for all reflections included in the refinement: 0.0836
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes