Information card for entry 2229121

Structure parameters

• Chemical name: Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I) dichloridocopper(II)
• Formula: C24 H16 Cl3 Cu2 N4
• Calculated formula: C24 H16 Cl3 Cu2 N4
• SMILES: [Cu]12(Cl)([n]3cccc4ccc5ccc[n]1c5c34)[n]1cccc3ccc4ccc[n]2c4c13.[Cu]([Cl-])Cl
• Title of publication: Chloridobis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')copper(I) dichloridocopper(II)
• Authors of publication: Meng, Qingfen; Chen, Yanmei; Li, Bing; Chen, Sanping; Gao, Shengli
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: m226
• a: 9.8137 ± 0.0003 Å
• b: 17.8813 ± 0.0006 Å
• c: 26.2679 ± 0.0007 Å
• α: 90°
• β: 90.535 ± 0.001°
• γ: 90°
• Cell volume: 4609.3 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0658
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes