High-Level ab Initio Calculations of Torsional Potential of Phenol, Anisole, and o-Hydroxyanisole: Effects of Intramolecular Hydrogen Bond
- 25 January 2000
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry A
- Vol. 104 (6), 1332-1336
- https://doi.org/10.1021/jp993607e
Abstract
No abstract availableKeywords
This publication has 52 references indexed in Scilit:
- High resolution UV spectroscopy of phenol and the hydrogen bonded phenol-water clusterThe Journal of Chemical Physics, 1996
- The syn rotational barrier in butaneJournal of the American Chemical Society, 1990
- Remarks on the barrier to rotation about the Csp2—O bond in anisoleCanadian Journal of Chemistry, 1989
- Rotational potential surface for alkanes: Basis set and electron correlation effects on the conformations of n-butaneThe Journal of Chemical Physics, 1984
- Elektronenstruktur von Alkyl‐aryl‐ und Alkyl‐vinyl‐ethernEuropean Journal of Inorganic Chemistry, 1979
- Photoelectron spectra of psychotropic drugs. 1. Phenethylamines, tryptamines, and LSDJournal of the American Chemical Society, 1977
- Molecular orbital theory of the electronic structure of organic compounds. XII. Conformations, stabilities, and charge distributions in monosubstituted benzenesJournal of the American Chemical Society, 1972
- Vibrational spectra and torsional barriers of anisole and some monohalogen derivativesSpectrochimica Acta Part A: Molecular Spectroscopy, 1969
- Microwave Spectrum, Structure, and Internal Rotation of Dimethyl EtherThe Journal of Chemical Physics, 1959
- Note on an Approximation Treatment for Many-Electron SystemsPhysical Review B, 1934