Information card for entry 2234183

Structure parameters

• Chemical name: Tetrakis{2-[2-(2,6-dichloroanilino)phenyl]ethanoato- κ^2^<i>O</i>:<i>O</i>'}bis[(dimethyl sulfoxide-κ<i>O</i>)copper(II)](<i>Cu</i>—<i>Cu</i>)
• Formula: C60 H52 Cl8 Cu2 N4 O10 S2
• Calculated formula: C60 H52 Cl8 Cu2 N4 O10 S2
• SMILES: O1[Cu]234([O]=C(Cc5ccccc5Nc5c(cccc5Cl)Cl)O[Cu]2([O]=C(Cc2ccccc2Nc2c(cccc2Cl)Cl)O3)(OC(Cc2ccccc2Nc2c(cccc2Cl)Cl)=[O]4)([O]=C1Cc1ccccc1Nc1c(cccc1Cl)Cl)[O]=S(C)C)[O]=S(C)C
• Title of publication: Tetrakis{2-[2-(2,6-dichloroanilino)phenyl]ethanoato-κ^2^<i>O</i>:<i>O</i>'}bis[(dimethyl sulfoxide-κ<i>O</i>)copper(II)](<i>Cu</i>—<i>Cu</i>): a binuclear Cu^II^ complex with the non-steroidal anti-inflammatory drug diclofenac
• Authors of publication: Sayen, Stéphanie; Guillon, Emmanuel
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m474 - m475
• a: 10.357 ± 0.005 Å
• b: 12.787 ± 0.005 Å
• c: 12.925 ± 0.005 Å
• α: 81.605 ± 0.005°
• β: 75.561 ± 0.005°
• γ: 68.489 ± 0.005°
• Cell volume: 1539.4 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0418
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0712
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes