Information card for entry 7701152

Structure parameters

• Formula: C52 H70 Cl2 Co N2 O4
• Calculated formula: C52 H70 Cl2 Co N2 O4
• Title of publication: Influence of nitro substituents on the redox, electronic, and proton reduction catalytic behavior of phenolate-based [N₂O₃]-type cobalt(iii) complexes.
• Authors of publication: Basu, Debashis; Mazumder, Shivnath; Kpogo, Kenneth K.; Verani, Cláudio N
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 39
• Pages of publication: 14669 - 14677
• a: 12.2154 ± 0.001 Å
• b: 14.5086 ± 0.0012 Å
• c: 14.9325 ± 0.0011 Å
• α: 91.171 ± 0.004°
• β: 109.941 ± 0.003°
• γ: 95.805 ± 0.004°
• Cell volume: 2470.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.053
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.1084
• Weighted residual factors for all reflections included in the refinement: 0.1212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No