Conformational, Chemical Reactivity, Thermodynamic Properties, and the SEM Study of Yohimbine Hydrochloride

Authors

  • Bhawani Datt Joshi Department of Physics, Siddhanath Sc. Campus, Mahendranagar, Tribhuvan University, Nepal
  • Poonam Tandon Department of Physics, University of Lucknow, Lucknow-226007, UP, India
  • Sudha Jain Department of Chemistry, University of Lucknow, Lucknow-226007, UP, India

DOI:

https://doi.org/10.3126/kuset.v9i1.63855

Keywords:

YHCl, DFT, SEM, Thermodynamic property, Reactivity descriptor

Abstract

We have presented a study on structural conformation of yohimbine hydrochloride using density functional theory (DFT) method. A short description about the surface morphology with scanning electron microscopy imaging has been included. Correlation between different thermodynamic properties with variation in the temperature has been given. The global and local chemical reactivity descriptors have been calculated, from which nucleophilicity and electrophilicity of the given atomic sites in the molecule can be known.

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Published

2013-07-31

How to Cite

Joshi, B. D., Tandon, P., & Jain, S. (2013). Conformational, Chemical Reactivity, Thermodynamic Properties, and the SEM Study of Yohimbine Hydrochloride. Kathmandu University Journal of Science, Engineering and Technology, 9(1), 152–160. https://doi.org/10.3126/kuset.v9i1.63855

Issue

Vol. 9 No. 1 (2013)

Section

Original Research Articles

License

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