Information card for entry 2237032

Structure parameters

• Chemical name: Chlorido(4-methylpyridin-2-amine-κ<i>N</i>^1^)(2-{[(4-methylpyridin-2- yl)imino-κ<i>N</i>]methyl}phenolato-κ<i>O</i>)copper(II)
• Formula: C19 H19 Cl Cu N4 O
• Calculated formula: C19 H19 Cl Cu N4 O
• SMILES: [Cu]12(Cl)(Oc3c(cccc3)C=[N]2c2[n]1ccc(c2)C)[n]1c(N)cc(cc1)C
• Title of publication: Chlorido(4-methylpyridin-2-amine-κ<i>N</i>^1^)(2-{[(4-methylpyridin-2-yl)imino-κ<i>N</i>]methyl}phenolato-κ<i>O</i>)copper(II)
• Authors of publication: Bhagyaraju, Bussa; Sambasiva Rao, P.; Swu, Toka
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: m1523
• a: 17.443 ± 0.004 Å
• b: 11.2197 ± 0.0019 Å
• c: 9.4435 ± 0.0019 Å
• α: 90°
• β: 92.67 ± 0.02°
• γ: 90°
• Cell volume: 1846.1 ± 0.6 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 6
• 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: 0.1102
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.0962
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes