Information card for entry 7103326

Structure parameters

• Formula: C17 H26 Cl2 Cu N2 O2
• Calculated formula: C22.6667 H34.6667 Cl2.66667 Cu1.33333 N2.66667 O2.66667
• SMILES: [Cu]12(Cl)(Cl)[O](c3c(cc(cc3C[NH+]3CCCCC3)C(C)(C)C)C=[N]1O)[Cu]1(Cl)(Cl)[O]2c2c(cc(cc2C[NH+]2CCCCC2)C(C)(C)C)C=[N]1O
• Title of publication: Transport of metal salts by zwitterionic ligands; simple but highly efficient salicylaldoxime extractants.
• Authors of publication: Forgan, Ross S; Davidson, James E; Galbraith, Stuart G; Henderson, David K; Parsons, Simon; Tasker, Peter A; White, Fraser J
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 34
• Pages of publication: 4049 - 4051
• a: 16.542 ± 0.002 Å
• b: 24.736 ± 0.003 Å
• c: 10.4427 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4272.9 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.067
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1361
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No