Spectroscopic and Theoretical Study of the Intramolecular π-Type Hydrogen Bonding and Conformations of 2-Cyclopenten-1-ol

Spectroscopic and Theoretical Study of the Intramolecular π-Type Hydrogen Bonding and Conformations of 2-Cyclopenten-1-ol

The conformations of 2-cyclopenten-1-ol (2CPOL) have been investigated by high-level theoretical computations and infrared spectroscopy. The six conformational minima correspond to specific values of the ring-puckering and OH internal rotation coordinates. The conformation with the lowest energy pos...

Full description

Bibliographic Details
Main Authors: Esther J. Ocola, Jaan Laane
Format: Article
Language:English
Published: MDPI AG 2021-02-01
Series:Molecules
Subjects:
2-cyclopenten-1-ol
π-type intramolecular hydrogen bonding
infrared spectroscopy
conformations
potential energy surface
theoretical calculations
Online Access:https://www.mdpi.com/1420-3049/26/4/1106

Internet

https://www.mdpi.com/1420-3049/26/4/1106

Similar Items