Information card for entry 2203188

Structure parameters

• Chemical name: bis[N,N'-bis(pyridin-2-ylmethyl)pyrazine-2,3-dicarboxamide]cobalt(III) tris(perchlorate) acetonitrile 3.5-solvate
• Formula: C43 H42.5 Cl3 Co N15.5 O16
• Calculated formula: C43 H42.5 Cl3 Co N15.5 O16
• Title of publication: A mononuclear cobalt(III) complex of the ligand <i>N,N</i>'-bis(pyridin-2-ylmethyl)pyrazine-2,3-dicarboxamide
• Authors of publication: Dilovan S. Cati; Helen Stoeckli-Evans
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: m174 - m176
• a: 13.174 ± 0.005 Å
• b: 14.061 ± 0.005 Å
• c: 15.905 ± 0.005 Å
• α: 100.197 ± 0.005°
• β: 111.189 ± 0.005°
• γ: 99.505 ± 0.005°
• Cell volume: 2618 ± 1.6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1481
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No