Information card for entry 7063244

Structure parameters

• Formula: C22 H30 Cu2 N6 O2 S2
• Calculated formula: C22 H30 Cu2 N6 O2 S2
• Title of publication: Synthesis, structure and biological properties of a series of dicopper(bis-thiosemicarbazone) complexes
• Authors of publication: Cebotari, Diana; Calancea, Sergiu; Garbuz, Olga; Balan, Greta; Marrot, Jérôme; Shova, Sergiu; Guérineau, Vincent; Touboul, David; Tsapkov, Victor; Gulea, Aurelian; Floquet, Sébastien
• Journal of publication: New Journal of Chemistry
• Year of publication: 2024
• Journal volume: 48
• Journal issue: 26
• Pages of publication: 12043 - 12053
• a: 12.7043 ± 0.0002 Å
• b: 13.4872 ± 0.0003 Å
• c: 17.5847 ± 0.0003 Å
• α: 93.979 ± 0.002°
• β: 111.099 ± 0.001°
• γ: 113.048 ± 0.001°
• Cell volume: 2507.85 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1808
• Weighted residual factors for all reflections included in the refinement: 0.1835
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.72932 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No