Information card for entry 2222156

Structure parameters

• Chemical name: Bis{μ-1,3-bis[(benzimidazol-1-yl)methyl]benzene- κ^2^<i>N</i>^3^:<i>N</i>^3'^}bis[dichloridozinc(II)] dimethylformamide disolvate
• Formula: C50 H50 Cl4 N10 O2 Zn2
• Calculated formula: C50 H50 Cl4 N10 O2 Zn2
• SMILES: c12ccccc1n1c[n]2[Zn](Cl)(Cl)[n]2cn(Cc3cc(Cn4c5c(cccc5)[n](c4)[Zn]([n]4cn(Cc5cc(C1)ccc5)c1c4cccc1)(Cl)Cl)ccc3)c1c2cccc1.N(C=O)(C)C.N(C=O)(C)C
• Title of publication: Bis{μ-1,3-bis[(benzimidazol-1-yl)methyl]benzene-κ^2^<i>N</i>^3^:<i>N</i>^3'^}bis[dichloridozinc(II)] dimethylformamide disolvate
• Authors of publication: Zhao, Li-Zhen; Li, Ping; Cao, Bao-Liang; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: m613
• a: 24.0069 ± 0.0005 Å
• b: 9.8217 ± 0.0002 Å
• c: 23.9723 ± 0.0005 Å
• α: 90°
• β: 117.695 ± 0.001°
• γ: 90°
• Cell volume: 5004.82 ± 0.19 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.089
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes