Information card for entry 2220827

Structure parameters

• Chemical name: [<i>N</i>,<i>N</i>'-Bis(4-chlorobenzylidene)-2,2-dimethylpropane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>']iodidocopper(I)
• Formula: C19 H20 Cl2 Cu I N2
• Calculated formula: C19 H20 Cl2 Cu I N2
• SMILES: c1cc(ccc1C=[N]1CC(C)(C)C[N]([Cu]1I)=Cc1ccc(cc1)Cl)Cl
• Title of publication: [<i>N</i>,<i>N</i>'-Bis(4-chlorobenzylidene)-2,2-dimethylpropane-1,3-diamine-κ^2^<i>N,N</i>']iodidocopper(I)
• Authors of publication: Kia, Reza; Fun, Hoong-Kun; Kargar, Hadi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m197
• a: 16.277 ± 0.0001 Å
• b: 12.2983 ± 0.0001 Å
• c: 10.6255 ± 0.0001 Å
• α: 90°
• β: 92.249 ± 0.001°
• γ: 90°
• Cell volume: 2125.37 ± 0.03 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.03
• Residual factor for significantly intense reflections: 0.0239
• Weighted residual factors for significantly intense reflections: 0.0627
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes