Information card for entry 2230565

Structure parameters

• Chemical name: (2-{[2-(2-Aminoethylamino)ethylimino]methyl}phenolato- κ^4^<i>O</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')copper(II) perchlorate
• Formula: C11 H16 Cl Cu N3 O5
• Calculated formula: C11 H16 Cl Cu N3 O5
• SMILES: [Cu]123Oc4c(C=[N]3CC[NH]2CC[NH2]1)cccc4.Cl(=O)(=O)(=O)[O-]
• Title of publication: (2-{[2-(2-Aminoethylamino)ethylimino]methyl}phenolato-κ^4^<i>O</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')copper(II) perchlorate
• Authors of publication: Dieng, Moussa; Barry, Aliou Hamady; Gaye, Mohamed; Sall, Abdou Salam; Pérez-Lourido, Paulo; Valencia-Matarranz, Laura
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 7
• Pages of publication: m830 - m831
• a: 10.371 ± 0.003 Å
• b: 12.615 ± 0.003 Å
• c: 13.39 ± 0.003 Å
• α: 108.24 ± 0.004°
• β: 105.568 ± 0.004°
• γ: 108.154 ± 0.004°
• Cell volume: 1445.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.1058
• Weighted residual factors for all reflections included in the refinement: 0.131
• 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