Information card for entry 7709968

Structure parameters

• Formula: C34 H24 Cl4 N4 Ni O2
• Calculated formula: C34 H24 Cl4 N4 Ni O2
• SMILES: [Ni]123(Oc4c5[n]3c(C)ccc5c(Cl)cc4Cl)(Oc3c4[n]1c(C)ccc4c(Cl)cc3Cl)[n]1c3c4[n]2cccc4c(c(c3ccc1)C)C
• Title of publication: A new class of nickel(II) oxyquinoline-bipyridine complexes as potent anticancer agents induces apoptosis and autophagy in A549/DDP tumor cells through mitophagy pathways
• Authors of publication: Wang, Zhen-Feng; Wei, Qiao-Chang; Li, Jin-Xian; Zhou, Zhen; Zhang, Shuhua
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.3753 ± 0.0008 Å
• b: 12.7009 ± 0.0011 Å
• c: 14.4552 ± 0.0011 Å
• α: 82.985 ± 0.003°
• β: 80.795 ± 0.003°
• γ: 76.224 ± 0.003°
• Cell volume: 1643.9 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 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: 0.0588
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1057
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No