Molecular insights into the structural, spectroscopic, chemical shift characteristics, and molecular docking analysis of the carbamate insecticide fenobucarb

Molecular insights into the structural, spectroscopic, chemical shift characteristics, and molecular docking analysis of the carbamate insecticide fenobucarb

In this study, fenobucarb a carbamate pesticide has been analyzed for its structural, spectroscopic (FT-IR and FT-Raman), electronic (UV–Vis.), chemical shifts (NMR) and topological, and bioactivity using the theoretical DFT technique. In optimized geometry, the computed bond distance of N3-H29 is r...

Full description

Saved in:
Bibliographic Details
Main Authors: K. KrishnaKumar, M. Jenifer, T.J. Nandhini, M. Sridharan, G. Sabarinathan, Pallavi M. Shanthappa
Format: Article
Language:English
Published: Elsevier 2025-06-01
Series:Chemical Physics Impact
Subjects:
Fenobucarb
DFT
NMR
Topological insights
Molecular docking
Online Access:http://www.sciencedirect.com/science/article/pii/S2667022425000106
Tags: Add Tag
No Tags, Be the first to tag this record!

Similar Items

Similar Items