Information card for entry 2200504

Structure parameters

• Formula: C24 H40 Cl2 N8 Ni O8
• Calculated formula: C24 H40 Cl2 N8 Ni O8
• Title of publication: Acetonitrile{<i>N</i>-[2-(4,7-dimethyl-1,4,7-triazacyclonon-1-yl)ethyl]-<i>N</i>-[(1-methylbenzimidazol-2-yl)methyl]methylamine}nickel(II) bis(perchlorate) acetonitrile solvate
• Authors of publication: Daly, Robert I.; Taylor, Max R.; Martin, Lisandra L.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 7
• Pages of publication: m315 - m317
• a: 10.474 ± 0.001 Å
• b: 30.475 ± 0.002 Å
• c: 10.572 ± 0.001 Å
• α: 90°
• β: 111.54 ± 0.01°
• γ: 90°
• Cell volume: 3138.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 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: 0.078
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for all reflections: 0.132
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections: 1.649
• Goodness-of-fit parameter for all reflections included in the refinement: 1.63
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No