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
1. [1]
  Bhatti R S, Shah S, Suresh, et al. Int. J. Med. Chem., 2013:793260
2. [2]
  Heng S, Tieu W, Hautmann S, et al. J. Bioorg. Med. Chem., 2011, 19:7453-7463 doi: 10.1016/j.bmc.2011.10.042
3. [3]
  Arimori S, Matsubara O, Takada M, et al. R. Soc. Open Sci., 2016, 3(5):UNSP160102 doi: 10.1098/rsos.160102
4. [4]
  Spengler G, Ocsovszki I, Tönki ÁS, et al. Anticancer Res., 2015, 35:5915-5919
5. [5]
  Karami K, Hosseini-Kharat M, Shirani-Sarmazeh Z, et al. J. Coord. Chem., 2016, 69(5):763-778 doi: 10.1080/00958972.2016.1151876
6. [6]
  Maigali S S, Abd-El-Maksoud M A, El-Hussieny M, et al. J. Chem. Res., 2014, 38:754-761 doi: 10.3184/174751914X14179446629855
7. [7]
  Sabounchei S J, Panahimehr M, Khavasi H R, et al. Chem. Pap., 2014, 68:624-632
8. [8]
  Li X Y, Stephan J, Harms K, et al. Organometallics, 2004, 23:3359-3361 doi: 10.1021/om049742h
9. [9]
  Sabounchei S J, Ahmadi M, Nasri Z, et al. Tetrahedron Lett., 2013, 54:4656-4660 doi: 10.1016/j.tetlet.2013.06.064
10. [10]
  Brownie J H, Baird M C. Coord. Chem. Rev., 2008, 252:1734-1754 doi: 10.1016/j.ccr.2007.12.028
11. [11]
  Sabounchei S J, Dadrass A R, Nemattalab H. Asian J. Chem., 2008, 20:4329-4334
12. [12]
  Sabounchei S J, Samiee S, Salehzadeh S, et al. J. Organomet. Chem., 2010, 695:1441-1450 doi: 10.1016/j.jorganchem.2010.02.029
13. [13]
  Sabounchei S J, Zamanian M, Pourshahbaz M, et al. J. Chem. Res., 2016, 40:130-136 doi: 10.3184/174751916X14537279217786
14. [14]
  CrysAlisPro, Agilent Technologies, Yarnton, Oxfordshire, England, 2012.
15. [15]
  Sabounchei S J, Nemattalab H, Salehzadeh S, et al. J. Organomet. Chem., 2008, 693:1975-1985 doi: 10.1016/j.jorganchem.2008.02.025
16. [16]
  Groom C R, Allen F H. Angew. Chem. Int. Ed., 2014, 53:662-671 doi: 10.1002/anie.201306438
17. [17]
  Sheldrick G M. Acta Crystallogr. Sect. A:Found. Crystallogr., 2008, 64:112-122 doi: 10.1107/S0108767307043930
18. [18]
  Brandenburg K. Diamond Vers. 3.2k, Bonn, Germany, 2014.
19. [19]
  Labanowski J K, Andzelm J W. Density Functional Methods in Chemistry. New York:Springer, 1991:443
20. [20]
  Schmidt M W, Baldridge K K, Boatz J A, et al. J. Comput. Chem., 1993, 11:1347-1363
21. [21]
  Lee C T, Yang W T, Parr R G. Phys. Rev. B:Condens. Matter, 1988, 37:785-789 doi: 10.1103/PhysRevB.37.785
22. [22]
  Yamada J, Hashimoto H, Inomata Y, et al. Bull. Chem. Soc. Jpn., 1994, 67:3224-3230 doi: 10.1246/bcsj.67.3224
23. [23]
  Cowan S W, Dakternieks D, Gable R W, et al. Aust. J. Chem., 1986, 39:547-556 doi: 10.1071/CH9860547
24. [24]
  Kalyanasundari M, Panchanatheswaran K, Robinson W T, et al. J. Organomet. Chem., 1995, 491:103-109 doi: 10.1016/0022-328X(94)05217-Y
25. [25]
  Sabounchei S J, Nemattalab H, Salehzadeh S, et al. Inorg. Chim. Acta, 2009, 362:105-112 doi: 10.1016/j.ica.2008.03.015
26. [26]
  Spencer E C, Mariyatra M B, Howard J A K, et al. J. Organomet. Chem., 2007, 692:1081-1086 doi: 10.1016/j.jorganchem.2006.11.002
27. [27]
  Sabounchei S J, Salehzadeh S, Hosseinzadeh M, et al. Polyhedron, 2011, 30:2486-2492 doi: 10.1016/j.poly.2011.06.033
28. [28]
  Sabounchei S J, Dadrass A R, Jafarzadeh M, et al. J. Organomet. Chem., 2007, 692:2500-2507 doi: 10.1016/j.jorganchem.2007.02.027
29. [29]
  Spencer E C, Kalyanasundari B, Mariyatra M B, et al. Inorg. Chim. Acta, 2006, 359:35-43 doi: 10.1016/j.ica.2005.09.006
30. [30]
  Dadrass A R, Ramazani A, Marjani A P, et al. Chin. J. Struct. Chem., 2015, 34(3):373-378
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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