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Fluorescence property and solvent effect on m-bromosalicylaldehyde derivative; insights from synthesis, characterization, antimicrobial activity and computational studies
- Source :
- Chemical Physics Impact; 20230101, Issue: Preprints
- Publication Year :
- 2023
-
Abstract
- •The compound was synthesized with reaction of 5-bromosalicylaldehyde and ethylenediamine.•Solvation study was done with DLPNO-CCSD(T) coupled cluster using water as the solvent.•The active sites and interaction were determined using molecular electrostatic potential, ELF, LOL, and RDG.•Electronic properties were analysed by UV-Visible spectrum and frontier molecular orbital analysis.•Compound is a good optical material.
Details
- Language :
- English
- ISSN :
- 26670224
- Issue :
- Preprints
- Database :
- Supplemental Index
- Journal :
- Chemical Physics Impact
- Publication Type :
- Periodical
- Accession number :
- ejs64058268
- Full Text :
- https://doi.org/10.1016/j.chphi.2023.100323