Information card for entry 2221637

Structure parameters

• Chemical name: Tetrakis(1-benzyl-1<i>H</i>-imidazole)dichloridonickel(II)
• Formula: C40 H40 Cl2 N8 Ni
• Calculated formula: C40 H40 Cl2 N8 Ni
• SMILES: [Ni]([n]1cn(cc1)Cc1ccccc1)([n]1cn(cc1)Cc1ccccc1)([n]1cn(cc1)Cc1ccccc1)([n]1cn(cc1)Cc1ccccc1)(Cl)Cl
• Title of publication: Tetrakis(1-benzyl-1<i>H</i>-imidazole)dichloridonickel(II)
• Authors of publication: Li, Hongjuan; Sun, Jufeng; Dai, Xianping
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 5
• Pages of publication: m564
• a: 7.296 ± 0.003 Å
• b: 17.117 ± 0.004 Å
• c: 29.651 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3703 ± 1.8 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.2068
• Residual factor for significantly intense reflections: 0.0791
• Weighted residual factors for significantly intense reflections: 0.1783
• Weighted residual factors for all reflections included in the refinement: 0.2307
• Goodness-of-fit parameter for all reflections included in the refinement: 1.144
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes