JOURNAL OF CHILEAN CHEMICAL SOCIETY

Vol 66 No 2 (2021): Journal of the Chilean Chemical Society
Original Research Papers

A NEW SYNTHETIC THIO-CHALCONE INTENDED AS A LIGAND FOR POLYMETALLIC COORDINATION COMPOUNDS: STRUCTURAL, ELECTROCHEMICAL AND THEORETICAL STUDY.

Yanko Moreno
Universidad Santo Tomás
Bio
Published June 13, 2021
Keywords
  • chalcone,
  • cyclic voltammetry,
  • DFT calculations,
  • crystal structure,
  • diffusion coefficient
How to Cite
Moreno, Y. (2021). A NEW SYNTHETIC THIO-CHALCONE INTENDED AS A LIGAND FOR POLYMETALLIC COORDINATION COMPOUNDS: STRUCTURAL, ELECTROCHEMICAL AND THEORETICAL STUDY. Journal of the Chilean Chemical Society, 66(2), 5190-5194. Retrieved from https://jcchems.com/index.php/JCCHEMS/article/view/1749

Abstract

The new chalcone, 1-(PYRIDIN-2-YL)-3-(THIOPHEN-2-YL)PROPENONE, has been synthesized and its crystal and molecular structure determined. An electrochemical characterization of the molecule disclosed some reversible and irreversible processes in its cathodic/anodic reactions. A density functional study was carried out in order to calculate the frontier molecular orbitals and the diffusion coefficient, which showed very good agreement with the experimental data.

17491.jpg

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