Information card for entry 7707309

Structure parameters

• Formula: C21 H18 Cu F N3 O4
• Calculated formula: C21 H18 Cu F N3 O4
• SMILES: [Cu]12(Oc3c(C(=[N]2N=C(O1)c1ccccc1)C)c(=O)oc(c3)C)[NH2]c1ccc(F)cc1
• Title of publication: Synthesis, characterization and utility of a series of novel copper(II) complexes as an excellent surface disinfectant against nosocomial infections
• Authors of publication: ., Richa; Kushwaha , Namrata; Negi, Sheetal; Kumar, Ajay; Zangrando, Ennio; Kataria, Ramesh; Saini, Vikram
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 9.086 ± 0.0002 Å
• b: 9.1382 ± 0.0002 Å
• c: 13.8154 ± 0.0003 Å
• α: 100.565 ± 0.002°
• β: 99.858 ± 0.002°
• γ: 114.86 ± 0.002°
• Cell volume: 982.71 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0399
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No