Information card for entry 1514191

Structure parameters

• Formula: C34 H24 Cu N2 O4
• Calculated formula: C34 H24 Cu N2 O4
• SMILES: [Cu]12(Oc3c4[n]1c(/C=C/c1c(O)cccc1)ccc4ccc3)Oc1c3[n]2c(/C=C/c2ccccc2O)ccc3ccc1
• Title of publication: Oxidative stress induced by copper and iron complexes with 8-hydroxyquinoline derivatives causes paraptotic death of HeLa cancer cells.
• Authors of publication: Barilli, Amelia; Atzeri, Corrado; Bassanetti, Irene; Ingoglia, Filippo; Dall'asta, Valeria; Bussolati, Ovidio; Maffini, Monica; Mucchino, Claudio; Marchio, Luciano
• Journal of publication: Molecular pharmaceutics
• Year of publication: 2014
• Journal volume: 11
• Journal issue: 4
• Pages of publication: 1151
• a: 10.167 ± 0.001 Å
• b: 21.499 ± 0.001 Å
• c: 12.025 ± 0.001 Å
• α: 90°
• β: 93.542 ± 0.002°
• γ: 90°
• Cell volume: 2623.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0481
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0952
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No