Information card for entry 2214546

Structure parameters

• Chemical name: [<it>N</it>-(2-Aminoethyl)-<it>N</it>-(2-{(<it>E</it>)-[9-(diethoxymethyl)-\ 1,10-phenanthrolin-2-yl]methylideneamino}ethyl)ethane-1,2-diamine]copper(II) bis(perchlorate)
• Formula: C24 H34 Cl2 Cu N6 O10
• Calculated formula: C24 H34 Cl2 Cu N6 O10
• SMILES: c12C=[N]3CC[N]45CC[NH2][Cu]35([n]2c2c3c(ccc2cc1)ccc(C(OCC)OCC)n3)[NH2]CC4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: [<i>N</i>-(2-Aminoethyl)-<i>N</i>-(2-{(<i>E</i>)-[9-(diethoxymethyl)-1,10-phenanthrolin-2-yl]methylideneamino}ethyl)ethane-1,2-diamine]copper(II) bis(perchlorate)
• Authors of publication: Keypour, Hassan; Goudarziafshar, Hamid; Brisdon, Alan K.; Pritchard, Robin G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2158 - m2159
• a: 14.1439 ± 0.0003 Å
• b: 16.606 ± 0.0003 Å
• c: 25.8952 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6082.1 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1381
• Residual factor for significantly intense reflections: 0.0742
• Weighted residual factors for significantly intense reflections: 0.1988
• Weighted residual factors for all reflections included in the refinement: 0.2555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes