Information card for entry 7717102

Structure parameters

• Common name: chloridodiflunisalato(2,9-dimethyl-1,10-phenathroline)zinc(ii)
• Chemical name: chloridodiflunisalato(2,9-dimethyl-1,10-phenathroline)zinc(ii)
• Formula: C27 H19 Cl F2 N2 O3 Zn
• Calculated formula: C27 H19 Cl F2 N2 O3 Zn
• Title of publication: Novel Zn(II), Co(II) and Cu(II) diflunisalato complexes with neocuproine and their exceptional antiproliferative activity against cancer cell lines
• Authors of publication: Smolková, Romana; Smolko, Lukáš; Samolova, Erika; Morgan, Ibrahim; Rennert, Robert; Kaluđerović, Goran
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 11.5013 ± 0.0001 Å
• b: 12.6985 ± 0.0001 Å
• c: 15.3433 ± 0.0001 Å
• α: 90°
• β: 95.733 ± 0.0006°
• γ: 90°
• Cell volume: 2229.67 ± 0.03 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 7
• 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: 0.0329
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0853
• Goodness-of-fit parameter for significantly intense reflections: 2.85
• Goodness-of-fit parameter for all reflections included in the refinement: 2.79
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No