Information card for entry 4336978

Structure parameters

• Formula: C22 H14 Cl6 Co N6
• Calculated formula: C22 H14 Cl6 Co N6
• SMILES: c1(c(cccc1Cl)Cl)/N=N/c1cccc[n]1[Co]([n]1ccccc1/N=N/c1c(cccc1Cl)Cl)(Cl)Cl
• Title of publication: Redox Noninnocence in Coordinated 2-(Arylazo)pyridines: Steric Control of Ligand-Based Redox Processes in Cobalt Complexes
• Authors of publication: Pradip Ghosh; Subhas Samanta; Suman K Roy; Sucheta Joy; Tobias Krämer; John E. McGrady; Sreebrata Goswami
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 14040 - 14049
• a: 13.346 ± 0.005 Å
• b: 13.8 ± 0.005 Å
• c: 14.367 ± 0.005 Å
• α: 90 ± 0.005°
• β: 105.227 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 2553.1 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.1073
• Weighted residual factors for all reflections included in the refinement: 0.1172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No