ISSN : 0970 - 020X, ONLINE ISSN : 2231-5039
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Abstract

Characterization of  Keto and Enol forms of Indoline-2,3-Dione-3-Oxime using Avogadro  Software Tool – A Theoretical Study

Katanguru Laxmi

DOI : http://dx.doi.org/10.13005/ojc/340310


Abstract:

Avogadro is a scientific software tool used as a molecule editor and visualizer. Avogadro  is very much useful in teaching as it helps in the building of realistic models. Indoline-2,3-dione-3-oxime (IDOX) (Isatin -3-oxime) is used as a anticonvulsant and is known for treating various disorders caused by release of amino acids responsible for anxiety and excitatory behavior. In view of the biological importance of IDOX ,the keto and enol forms of the molecule were constructed by using Avogadro 1.1 software . With the help of this software the molecular properties, atom Properties and bond  properties  of both  forms of  IDOX were determined and the presence of tautomerism between both forms of the compound IDOX is indicated. Standard molecular structure representations of  keto form and enol forms of the compound IDOX so obtained by using chemical builder Avogadro 1.1 enabled to understand the structural aspects of both forms of IDOX.

Keywords:

Avogadro; Anticonvulsant Activity; Indoline-2,3-Dione-3-Oxime; Keto and Enol Forms; Standard Molecular Structure Representations

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