TY - JOUR
T1 - Ab initio calculation of distortion and bonding energy components of the cis-trans conversion energy for formic, thiolformic and thionformic acids
AU - George, Philip
AU - Bock, Charles W.
AU - Schmiedekamp, Ann
PY - 1981/5/15
Y1 - 1981/5/15
N2 - The energy change in the formation of the intramolecular hydrogen-bonded ring conformers of formic, thiolformic and thionformic acids from the chain conformers has been divided up into distortion and bonding energy components, following the treatment of Smit, Derissen, and van Duijneveldt for the formation of the formic acid dimer.
AB - The energy change in the formation of the intramolecular hydrogen-bonded ring conformers of formic, thiolformic and thionformic acids from the chain conformers has been divided up into distortion and bonding energy components, following the treatment of Smit, Derissen, and van Duijneveldt for the formation of the formic acid dimer.
UR - http://www.scopus.com/inward/record.url?scp=4243838332&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=4243838332&partnerID=8YFLogxK
U2 - 10.1016/0009-2614(81)80072-3
DO - 10.1016/0009-2614(81)80072-3
M3 - Article
AN - SCOPUS:4243838332
SN - 0009-2614
VL - 80
SP - 127
EP - 130
JO - Chemical Physics Letters
JF - Chemical Physics Letters
IS - 1
ER -