Information card for entry 7709981

Structure parameters

• Formula: C31 H24 N4 Ni O5
• Calculated formula: C31 H24 N4 Ni O5
• SMILES: [Ni]123(Oc4c5[n]3c(O)ccc5ccc4)(Oc3c4[n]1c(O)ccc4ccc3)[n]1cccc3c1c1[n]2cccc1cc3.OC
• 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: 10.442 ± 0.002 Å
• b: 10.492 ± 0.002 Å
• c: 12.933 ± 0.002 Å
• α: 96.981 ± 0.006°
• β: 90.412 ± 0.006°
• γ: 107.475 ± 0.006°
• Cell volume: 1340.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.093
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.0894
• Weighted residual factors for all reflections included in the refinement: 0.1017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No