Information card for entry 2005040

Structure parameters

• Formula: C10 H9 Cl2 Cu N3
• Calculated formula: C10 H9 Cl2 Cu N3
• SMILES: [Cu]1([n]2ccccc2Nc2cccc[n]12)(Cl)Cl
• Title of publication: Dichloro(di-2-pyridylamine-<i>N</i>,<i>N</i>')copper(II)
• Authors of publication: Spodine, E.; Atria, A. M.; Baggio, R.; Garland, M. T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1407 - 1410
• a: 14.664 ± 0.013 Å
• b: 7.697 ± 0.008 Å
• c: 5.08 ± 0.005 Å
• α: 90°
• β: 96.71 ± 0.01°
• γ: 90°
• Cell volume: 569.4 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0387
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for all reflections: 0.0886
• Weighted residual factors for significantly intense reflections: 0.0877
• Goodness-of-fit parameter for all reflections: 1.148
• Goodness-of-fit parameter for significantly intense reflections: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No