Information card for entry 1513896

Structure parameters

• Formula: C26 H28 Cu F2 N4 O2 S2
• Calculated formula: C26 H28 Cu F2 N4 O2 S2
• Title of publication: Crystal structures and antimicrobial activities of copper(II) complexes of fluorine-containing thioureido ligands
• Authors of publication: Liu, Huanhuan; Yang, Wen; Zhou, Weiqun; Xu, Yunlong; Xie, Juan; Li, Mengying
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 405
• Pages of publication: 387 - 394
• a: 19.894 ± 0.003 Å
• b: 19.894 ± 0.003 Å
• c: 13.562 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5367.4 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.1062
• Residual factor for significantly intense reflections: 0.0764
• Weighted residual factors for significantly intense reflections: 0.1448
• Weighted residual factors for all reflections included in the refinement: 0.1601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No