Synthesis, crystal structure, EPR spectroscopy, and DFT studies of a mononuclear oxovanadium(IV) Schiff base complex with antioxidant activity

Published: 22 September 2026| Version 1 | DOI: 10.17632/d8gfjytfpt.1
Contributors:
Arockiasamy Sebastian,

Description

CheckCIF file and DFT studies output data files

Files

Steps to reproduce

The data contains a crystallography CheckCIF file obtained from CCDC after depositing the single crystal. The second and third files are DFT analysis output files of the oxovanadium(IV) complex obtained after the analysis using Gaussian software.

Institutions

Categories

Single Crystal, DFT Method Application

Licence