Volume : VI, Issue : II, February - 2017

SYNTHESIS AND COMPUTATIONAL STUDIES OF PYRIDYLMETHYL-(1H)-TETRAZOLES

Suma. S, B. Prasanna

Abstract :

 A convenient procedure for the synthesis of 4-pyridylmethyl-1H-tetrazole has been developed from 4-methylpyridine by ominating with NBS, cyanation than followed by treated with sodium azide in the presence of [Bmim]BF4 ionic liquid. In this we have studied structure, thermal, electro static potential, bond lengths and bond angles of 4-Pyridylmethyltetrazole. And also we have studied frontier orbital HOMO-LUMO surfaces, Molecular electrostatic potential surfaces. A computational study was conducted by Argus Lab 4.0.1 to obtain the most active conformation and to analyze its excited-state properties

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Article: Download PDF    DOI : https://www.doi.org/10.36106/gjra  

Cite This Article:

Suma. S, B. Prasanna, SYNTHESIS AND COMPUTATIONAL STUDIES OF PYRIDYLMETHYL-(1H)-TETRAZOLES, GLOBAL JOURNAL FOR RESEARCH ANALYSIS : Volume-6, Issue-2, February‾2017


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