Abinitio Studies of Structural Features Not Easily Amenable to Experiment .4. Molecular structure and conformational analysis of carbonic acid.

by Williams, J. O.; VanAlsenoy, C.; Schaefer, Lothar

The conformational anal. of carbonic acid was carried out using Pulay's force method (1969). The planar forms of carbonic acid are the most stable; the 90° conformation correspond to a max. of total energy.

Journal
Journal of Molecular Structure-Theochem
Volume
1
Issue
1
Year
1981
Start Page
109-112
URL
https://dx.doi.org/10.1016/0166-1280(81)85118-4
ISBN/ISSN
0166-1280
DOI
10.1016/0166-1280(81)85118-4