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

Authors

  • Bhawani Dat 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

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.

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). Retrieved from https://journals.ku.edu.np/kuset/article/view/370

Issue

Vol. 9 No. 1 (2013): Kathmandu University for Science, Engineering and Technology (KUSET)

Section

Original Research Articles
Creative Commons License

This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

This work is licensed under CC BY-SA 4.0