Information card for entry 7056006

Structure parameters

• Formula: C26 H18 Cu N4 O2
• Calculated formula: C26 H18 Cu N4 O2
• SMILES: [Cu]123([N](N=C(O2)c2ccccc2)=Cc2c(O3)cccc2)[n]2cccc3ccc4ccc[n]1c4c23
• Title of publication: Copper(ii) complexes with benzhydrazone-related ligands: synthesis, structural studies and cytotoxicity assay
• Authors of publication: Cindrić, Marina; Bjelopetrović, Alen; Pavlović, Gordana; Damjanović, Vladimir; Lovrić, Jasna; Matković-Čalogović, Dubravka; Vrdoljak, Višnja
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 6
• Pages of publication: 2425
• a: 17.7697 ± 0.001 Å
• b: 10.7634 ± 0.0007 Å
• c: 11.4808 ± 0.0006 Å
• α: 90°
• β: 103.834 ± 0.006°
• γ: 90°
• Cell volume: 2132.1 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0894
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1051
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No