Information card for entry 7103328

Structure parameters

• Formula: C34 H52 Cu N6 O10
• Calculated formula: C34 H52 Cu N6 O10
• SMILES: c12O[Cu]3([N](O)=Cc2cc(cc1C[NH+]1CCCCC1)C(C)(C)C)Oc1c(cc(cc1C[NH+]1CCCCC1)C(C)(C)C)C=[N]3O.N(=O)(=O)[O-].N(=O)(=O)[O-]
• 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: 11.894 ± 0.0006 Å
• b: 11.162 ± 0.0006 Å
• c: 14.841 ± 0.0007 Å
• α: 90°
• β: 112.682 ± 0.003°
• γ: 90°
• Cell volume: 1817.92 ± 0.16 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0487
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No