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Synthesis and Structural Assessment of Methyl 2-((4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetate (phpy2NS) and its complex with HgCl2.
Published:
21 May 2018
by MDPI
in The 1st International Electronic Conference on Crystals
session Crystal Engineering
Abstract:
Reaction of 2-cyanopyridine with N-phenylthiosemicarbazideafforded the 4-phenyl-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione. Methyl 2-((4-phenyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetate (phpy2NS, 1), derived from this 1,2,4-triazole-3-thione, was obtained by reaction with chloroacetic acid followed by an acid-catalyzed esterification of the carboxylic acid with methyl alcohol. Synthesis of a Hg(II) complex, [Hg(phpy2NS)Cl2] (2), has been performed using the ligand (1) and HgCl2. The molecular and supramolecular structures of the ligand and the complex, were studied by X-ray diffractometry.
Keywords: 1,2,4-triazole ligands; Hg(II) complexes; crystal engineering; supramolecular architectures; hydrogen bond.
Comments on this paper
Samuel Hernandez Anzaldo
29 May 2018
Bonding nature
The authors present a very nice work. In many books or articles, the limits of "classical H-bonding" differs. Which parameter did you use to evaluate this treat? Another thing that seems unclear to me, is the charges of the molecule. Is it a neutral molecule? If not, ecould you clarify the charges, it was hard to see with the figure that you present.
Indigo Indigo
6 September 2018
Structural Assessment
In this blog I have very interesting updates on forum conference to make uk essay writing points. The figures you will easily find from the paper to view more important charges and essay online articles.