Information card for entry 7719685

Structure parameters

• Formula: C61 H59 B Cu2 F3 N5 O6 S Se
• Calculated formula: C61 H59 B Cu2 F3 N5 O6 S Se
• Title of publication: Structural influences on the oxidation and anticancer activities of dicopper(II) complexes containing different selenium and sulfur ligands.
• Authors of publication: Durigon, Daniele C.; Ribeiro, Ronny R.; Espindola-Moreno, Olivia; León, Ignacio E; Poneti, Giordano; Bortoluzzi, Adailton J.; Peralta, Rosely A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 47
• Pages of publication: 17495 - 17506
• a: 23.037 ± 0.003 Å
• b: 10.1719 ± 0.0014 Å
• c: 23.904 ± 0.003 Å
• α: 90°
• β: 94.804 ± 0.002°
• γ: 90°
• Cell volume: 5581.7 ± 1.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 9
• 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: 0.0523
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No