Citation: Mahsa Pourmirza, Shahla Ebrahimnezhad, Ali Ramazani, Aidin Bahrami, Sholeh. Alaei, Ali. Reza Dadrass. X-ray Crystallography, Spectral Characterization and Computational Studies of Mercury(Ⅱ) Complex with 1-(p-Tolyl)-2-(tri-p-tolyl-λ⁵-phosphanylidene)ethan-1-one[J]. Chinese Journal of Inorganic Chemistry, ;2019, 35(2): 344-350. doi: 10.11862/CJIC.2019.031 shu

X-ray Crystallography, Spectral Characterization and Computational Studies of Mercury(Ⅱ) Complex with 1-(p-Tolyl)-2-(tri-p-tolyl-λ⁵-phosphanylidene)ethan-1-one

1.
Department of Chemistry, Faculty of Science, Urmia University, P O Box 57153-165, Urmia, Iran
2.
Department of Chemistry, Faculty of Science, Zanjan University, P O Box 45195-313, Zanjan, Iran
3.
Department of physics, Faculty of Science, Urmia branch, Islamic Azad University, Urmia, Iran

Corresponding author: Ali. Reza Dadrass, dadrassi@yahoo.com
Received Date: 14 September 2018
Revised Date: 3 December 2018

Figures(8)

The α-phosphorus ligand 1-(p-tolyl)-2-(tri-p-tolyl-λ⁵-phosphanylidene)ethan-1-one(L) was prepared by the reaction of 2-bromo-1-(p-tolyl)ethan-1-one with tri(p-tolyl) phosphine. The reactions of L with cadmium chloride and mercury bromide resulted in[Cd(L)Cl₂]₂ (C1) and[Hg(L)(μ₂-Br)Br]₂ (C2), respectively. The complexes were characterized by IR and NMR (¹H, ¹³C, ³¹P). The structure of C2 was detected by single crystal X-ray diffraction and its DFT computational studies at B3LYP/6-31G^* level were also performed to reveal the interaction between the reaction site of complex C2 and nucleophilic groups such as Schiff base.
- phosphorus ligand,
- mercury(Ⅱ) halide complex,
- tri(p-tolyl) phosphine
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沈阳化工大学材料科学与工程学院沈阳 110142

X-ray Crystallography, Spectral Characterization and Computational Studies of Mercury(Ⅱ) Complex with 1-(p-Tolyl)-2-(tri-p-tolyl-λ5-phosphanylidene)ethan-1-one

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通讯作者: 陈斌, bchen63@163.com

X-ray Crystallography, Spectral Characterization and Computational Studies of Mercury(Ⅱ) Complex with 1-(p-Tolyl)-2-(tri-p-tolyl-λ⁵-phosphanylidene)ethan-1-one