Information card for entry 7709630

Structure parameters

• Formula: C18 H12 F2 N6 O4 Zn
• Calculated formula: C18 H12 F2 N6 O4 Zn
• Title of publication: Novel 5-fluorouracil complexes of Zn(II) with pyridine-based ligands as potential anticancer agents
• Authors of publication: Icsel, Ceyda; Yilmaz, Veysel T.; Aygün, Muhittin; Erkisa, merve; Ulukaya, Engin
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 16.103 ± 0.003 Å
• b: 8.187 ± 0.0011 Å
• c: 15.934 ± 0.003 Å
• α: 90°
• β: 111.98 ± 0.02°
• γ: 90°
• Cell volume: 1948 ± 0.6 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1458
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1178
• Weighted residual factors for all reflections included in the refinement: 0.1545
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No