Citation: Hao-Miao LI, Jia-Le ZHAO, Deng-Meng SONG, Qing SHI, Ning WANG, Jun LI, Wen-Hua XU. Unusual Coordination Mode of Tetradentate Diiminedioxime Ligand in a Mononickel(Ⅱ) Complex: Synthesis, Characterization, and Computational Study[J]. Chinese Journal of Structural Chemistry, ;2021, 40(6): 746-752. doi: 10.14102/j.cnki.0254–5861.2011–3002 shu

Unusual Coordination Mode of Tetradentate Diiminedioxime Ligand in a Mononickel(Ⅱ) Complex: Synthesis, Characterization, and Computational Study

Key Laboratory of Synthetic and Natural Functional Molecule of the Ministry of Education, College of Chemistry & Materials Science, Northwest University, Xi'an 710069, China

Corresponding author: Qing SHI, chemnw@aliyun.com Wen-Hua XU, xuwenhua.qf@gmail.com
Received Date: 16 October 2020
Accepted Date: 29 November 2020

Fund Project: the Natural Science Foundation of China 21773184the Natural Science Foundation of China 21671158

Figures(5)

In this work, it is found that 1, 8-dihydroxyimino-1, 2, 7, 8-tetraphenyl-3, 6-diazocta-2, 6-diene (^PhdoenH₂) could react with nickel(Ⅱ) salt to yield a mononickel complex Ni(^Phdoen) (1) with unusual [2N2O]-coordinated mode, while the analogous diimine-dioxime ligands usually form the [4N]-coordinated mode. The novel complex 1 has been carefully characterized by ¹H NMR, elemental analysis, and X-ray diffraction structure analysis. The influences of the coordination modes on the structures and redox properties have been further investigated. Theoretical investigations revealed that the different coordination modes were ascribed to the thermodynamic properties of ligands.
- coordination modes,
- diiminedioxime,
- mononickel complex,
- tetradentate ligands,
- N,O ligands
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