Information card for entry 2228118

Structure parameters

• Chemical name: [2,6-Bis(<i>p</i>-tolyliminomethyl)pyridine- κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']dichloridocopper(II)
• Formula: C21 H19 Cl2 Cu N3
• Calculated formula: C21 H19 Cl2 Cu N3
• SMILES: [n]12[Cu]3([N](=Cc1cccc2C=[N]3c1ccc(cc1)C)c1ccc(cc1)C)(Cl)Cl
• Title of publication: [2,6-Bis(<i>p</i>-tolyliminomethyl)pyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'']dichloridocopper(II)
• Authors of publication: Li, Xiao-Ping; Zhao, Jian-She; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: m1297
• a: 11.522 ± 0.0013 Å
• b: 35.522 ± 0.004 Å
• c: 9.327 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3817.4 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.034
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.0698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes