Information card for entry 7709548

Structure parameters

• Formula: C24 H22 Br2 Cl2 Cu N7 O7
• Calculated formula: C24 H22 Br2 Cl2 Cu N7 O7
• SMILES: [Cu]12([n]3c(cccc3Cl)N[N]2=Cc2cc(Br)ccc2O)[N](Nc2[n]1c(Cl)ccc2)=Cc1cc(Br)ccc1O.O.O.N(=O)(=O)[O-]
• Title of publication: Discovery of thirteen cobalt (II) and copper (II) salicylaldehyde Schiff base complexes that induce apoptosis and autophagy in human lung adenocarcinoma A549/DDP cells and that can overcome cisplatin resistance in vitro and in vivo
• Authors of publication: Chen, Yating; Zhang, Shaonan; Wang, Zhen-Feng; Wei, Qingmin; Zhang, Shuhua
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 22.6667 ± 0.001 Å
• b: 7.2097 ± 0.0004 Å
• c: 21.1442 ± 0.0013 Å
• α: 90°
• β: 115.478 ± 0.006°
• γ: 90°
• Cell volume: 3119.4 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 5
• Hermann-Mauguin space group symbol: I 1 2 1
• Hall space group symbol: I 2y
• Residual factor for all reflections: 0.0686
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No