Issue 18, 2009

Minimum electrophilicity principle: an analysis based upon the variation of both chemical potential and absolute hardness

Abstract

In this work, the minimum electrophilicity principle (MEP), assessed by either the electrophilicity power or the ΔNmax, is mathematically analysed through the variation of both chemical potential and chemical hardness. It appears that the decrease of the electrophilicity power and the decrease of the ΔNmax are ruled by similar expressions in which both the chemical potential and the absolute hardness should increase. A reduced expression at constant chemical potential shows that the MEP and the maximum hardness principle are equivalent. However it pops up from the monitoring of chemical processes such as bond formation and redox reactions that the variation of the chemical potential is the most important term.

Graphical abstract: Minimum electrophilicity principle: an analysis based upon the variation of both chemical potential and absolute hardness

Article information

Article type
Paper
Submitted
20 Oct 2008
Accepted
15 Jan 2009
First published
26 Feb 2009

Phys. Chem. Chem. Phys., 2009,11, 3417-3423

Minimum electrophilicity principle: an analysis based upon the variation of both chemical potential and absolute hardness

C. Morell, V. Labet, A. Grand and H. Chermette, Phys. Chem. Chem. Phys., 2009, 11, 3417 DOI: 10.1039/B818534D

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