Information card for entry 2205704

Structure parameters

• Chemical name: Tris({2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)cobalt(II) diperchlorate
• Formula: C21 H30 Cl2 Co N10 O8
• Calculated formula: C21 H30 Cl2 Co N10 O8
• SMILES: c1[n]2c(C=[N]3CCN4CC[N]5[Co]623([n]2ccn(c2C=5)C)[n]2ccn(c2C=[N]6CC4)C)n(c1)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Tris({2-[(1-methylimidazol-2-yl)methylimino]ethyl}amine)cobalt(II) diperchlorate
• Authors of publication: Chen, Hong-Mei; Yang Shi-Ping; Chen, Qiong-Qiong; Zhang, Fan; Chen Jia-Min; Yu, Xi-Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: m1001 - m1003
• a: 10.8349 ± 0.0007 Å
• b: 10.8349 ± 0.0007 Å
• c: 14.6028 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1484.62 ± 0.19 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 159
• Hermann-Mauguin space group symbol: P 3 1 c
• Hall space group symbol: P 3 -2c
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.1366
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes