Information card for entry 7031858

Structure parameters

• Common name: (nBu4N)2[Cu{Cu(Cl2opba)}2](dmso)4
• Formula: C30 H50 Cl2 Cu1.5 N3 O8 S2
• Calculated formula: C30 H50 Cl2 Cu1.5 N3 O8 S2
• Title of publication: Discrete trinuclear copper(ii) compounds as building blocks: the influence of the peripheral substituents on the magnetic coupling in oxamato-bridged complexes.
• Authors of publication: Barros, Wdeson P.; da Silva, Beatriz C.; Reis, Natália V; Pereira, Cynthia L. M.; Doriguetto, Antônio C; Cano, Joan; Pirota, Kleber R.; Pedroso, Emerson F.; Julve, Miguel; Stumpf, Humberto O.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 39
• Pages of publication: 14586 - 14595
• a: 10.07 ± 0.0002 Å
• b: 12.847 ± 0.0003 Å
• c: 15.558 ± 0.0004 Å
• α: 87.975 ± 0.002°
• β: 76.087 ± 0.002°
• γ: 69.626 ± 0.001°
• Cell volume: 1828.87 ± 0.08 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0544
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.1059
• Weighted residual factors for all reflections included in the refinement: 0.1146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No