Information card for entry 4341450

Structure parameters

• Formula: C23 H20 Cl4 N6 Ni
• Calculated formula: C23 H20 Cl4 N6 Ni
• SMILES: [Ni]12(Cl)(Cl)([n]3ccccc3N=[N]1c1ccccc1)[n]1c(N=[N]2c2ccccc2)cccc1.ClCCl
• Title of publication: Ligand-Centered Redox in Nickel(II) Complexes of 2-(Arylazo)pyridine and Isolation of 2-Pyridyl-Substituted Triaryl Hydrazines via Catalytic N-Arylation of Azo-Function.
• Authors of publication: Sengupta, Debabrata; Ghosh, Pradip; Chatterjee, Tanmay; Datta, Harashit; Paul, Nanda D.; Goswami, Sreebrata
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141105122752002
• a: 9.276 ± 0.005 Å
• b: 17.451 ± 0.005 Å
• c: 15.923 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90.812 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 2577.3 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0593
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.1037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No