Information card for entry 7709976

Structure parameters

• Formula: C32 H30 Cl2 N4 Ni O4
• Calculated formula: C32 H30 Cl2 N4 Ni O4
• SMILES: [Ni]123(Oc4c5[n]3cccc5c(Cl)cc4)(Oc3c4[n]1cccc4c(Cl)cc3)[n]1c(c3[n]2ccc(C)c3)cc(cc1)C.OC.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: 10.6177 ± 0.0005 Å
• b: 11.7231 ± 0.0005 Å
• c: 13.7986 ± 0.0006 Å
• α: 87.004 ± 0.001°
• β: 71.322 ± 0.001°
• γ: 71.063 ± 0.001°
• Cell volume: 1536.46 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0863
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.0965
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No