Information card for entry 2221494

Structure parameters

• Chemical name: Dichlorido{<i>N</i>-[1-(2-pyridyl)ethylidene]ethane-1,2-diamine}copper(II)
• Formula: C9 H13 Cl2 Cu N3
• Calculated formula: C9 H13 Cl2 Cu N3
• SMILES: [Cu]12(Cl)(Cl)[n]3c(C(=[N]1CC[NH2]2)C)cccc3
• Title of publication: Dichlorido{<i>N</i>-[1-(2-pyridyl)ethylidene]ethane-1,2-diamine}copper(II)
• Authors of publication: Wang, Qiang; Bi, Cai-Feng; Wang, Da-Qi; Fan, Yu-Hua
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: m439
• a: 7.2701 ± 0.001 Å
• b: 8.8008 ± 0.0012 Å
• c: 9.5773 ± 0.0015 Å
• α: 82.94 ± 0.002°
• β: 76.289 ± 0.001°
• γ: 85.751 ± 0.002°
• Cell volume: 590.16 ± 0.15 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0741
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.1379
• Weighted residual factors for all reflections included in the refinement: 0.1603
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes