Information card for entry 7709090

Structure parameters

• Formula: C20 H19 Cl2 Co N5
• Calculated formula: C20 H19 Cl2 Co N5
• SMILES: [Co]12(Cl)(Cl)[N](=Nc3[n]1c(ccc3)C[NH]2c1ccccc1)c1ccccc1.N#CC
• Title of publication: Polymerisation of styrene using pincer type amine functionalized azo aromatic complexes of Co(II) as catalysts.
• Authors of publication: Goswami, Bappaditya; Khatua, Manas; Samanta, Subhas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• Journal volume: 51
• Journal issue: 4
• Pages of publication: 1454 - 1463
• a: 8.0005 ± 0.0004 Å
• b: 22.9904 ± 0.001 Å
• c: 11.6606 ± 0.0007 Å
• α: 90°
• β: 102.494 ± 0.006°
• γ: 90°
• Cell volume: 2094 ± 0.19 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0777
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1709
• Weighted residual factors for all reflections included in the refinement: 0.1931
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No