Infrared Intensities, Atomic Charges, and Dipole Moments in the Fluoroethane Series Using Atomic Polar Tensor Analysis
Author:
Affiliation:
1. Department of Chemistry, Tufts University, Medford, Massachusetts 02155
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp971927x
Reference42 articles.
1. Ab Initio Calculations of Vibrational Frequencies and Infrared Intensities for Global Warming Potential of CFC Substitutes: CF3CH2F (HFC-134a)
2. Ab Initio Calculations on Fluoroethanes: Geometries, Dipole Moments, Vibrational Frequencies, and Infrared Intensities
3. Molecular properties of CFC substitutes from ab initio calculations: CFCl2CH3, CF2ClCH3, CHCl2CF3 and CHFClCF3
4. Electronic Population Analysis on LCAO‐MO Molecular Wave Functions. IV. Bonding and Antibonding in LCAO and Valence‐Bond Theories
5. Comparison of Two Atomic Charge Definitions, as Applied to the Hydrogen Fluoride Molecule
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