Relationship between the charge distribution and dipole moment functions of CO and the related molecules CS, SiO, and SiS.

J Phys Chem A

Department of Chemistry, Michigan State University, East Lansing, Michigan 48824-1322, USA.

Published: September 2006

The dipole moment functions of the titled molecules are written as the sum of a charge and induced atomic dipole contribution and the distance dependence interpreted in terms of these components. These two contributions have opposite signs over a large range of internuclear distances, and when they have equal magnitudes, the dipole moment vanishes. This happens with CO near the equilibrium bond length and is responsible for its small dipole moment. The dipole moment of CS is 0.770(ea0), rather large for a diatomic in which the two atoms have essentially the same electronegativities; this is because for CS, the two components of the dipole moment have the same sign at equilibrium and reinforce one another.

Download full-text PDF

Source
http://dx.doi.org/10.1021/jp058279zDOI Listing

Publication Analysis

Top Keywords

dipole moment
24
moment functions
8
dipole
7
moment
6
relationship charge
4
charge distribution
4
distribution dipole
4
functions molecules
4
molecules sio
4
sio sis
4

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!