Information card for entry 7059037

Structure parameters

• Chemical name: 6,6'-((1E,1'E)-(ethane-1,2-diylbis(azaneylylidene))bis(methaneylylidene))bis(3-(diethylamino)phenolato) copper (II) monohydrate
• Formula: C24 H34 Cu N4 O3
• Calculated formula: C24 H34 Cu N4 O3
• Title of publication: Diethylaminophenyl-based Schiff base Cu(II) and V(IV) complexes: experimental and theoretical study and cytotoxicity assays
• Authors of publication: Rocha, Mariana; Ruiz, María Carolina; Echeverría, Gustavo A.; Piro, Oscar E.; Leon, Ignacio; Di Virgilio, Ana Laura; Frontera, Antonio; Gil, Diego Mauricio
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• a: 19.5737 ± 0.0008 Å
• b: 9.8513 ± 0.0004 Å
• c: 12.4452 ± 0.0004 Å
• α: 90°
• β: 93.654 ± 0.003°
• γ: 90°
• Cell volume: 2394.88 ± 0.16 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• 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: 0.0474
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.1035
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No