Information card for entry 2220958

Structure parameters

• Common name: C6 H16 N O -, C10 H15 Cu2 O10, C H2 Cl2
• Chemical name: <i>catena</i>-Poly[diethyl(2-hydroxyethyl)ammonium [[tetra-μ-acetato-κ^8^O:O'-dicuprate(II)(<i>Cu</i>—<i>Cu</i>)]-μ-acetato- κ^2^O:O'] dichloromethane solvate]
• Formula: C17 H33 Cl2 Cu2 N O11
• Calculated formula: C17 H33 Cl2 Cu2 N O11
• SMILES: [Cu]1234([Cu]([O]=C(C)O1)(OC(C)=[O]2)([O]=C(C)O3)(OC(C)=[O]4)OC(=O)C)[O]=C(C)O[Cu]1234[Cu]([O]=C(C)O1)(OC(C)=[O]2)([O]=C(C)O3)OC(C)=[O]4.ClCCl.C(C)[NH+](CC)CCO.ClCCl.C(C)[NH+](CC)CCO
• Title of publication: <i>catena</i>-Poly[diethyl(2-hydroxyethyl)ammonium [[tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-dicuprate(II)(<i>Cu</i>—<i>Cu</i>)]-μ-acetato-κ^2^<i>O</i>:<i>O</i>'] dichloromethane solvate]
• Authors of publication: Shahid, Muhammad; Mazhar, Muhammad; O'Brien, Paul; Afzaal, Mohammad; Raftery, James
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: m163 - m164
• a: 17.6366 ± 0.0011 Å
• b: 12.1078 ± 0.0008 Å
• c: 11.9148 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2544.3 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes