Journal
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 15, Issue 5, Pages 1358-1363Publisher
ROYAL SOC CHEMISTRY
DOI: 10.1039/c2cp43884d
Keywords
-
Funding
- Italian MIUR
- COST-CMTS Action [CM1002]
Ask authors/readers for more resources
The structure and vibrational spectra of a marginally stable conformer of glycine (usually referred to as VIp or ttc) recently detected in low-temperature matrices have been characterized by a state-of-the-art computational approach allowing an overall quality for bond distances, rotational constants, conformational enthalpies and vibrational frequencies well within the chemical accuracy. The high accuracy of the computational results allows us to draw a fully consistent interpretation of the available experimental data and to obtain a more complete characterization of an elusive glycine conformer.
Authors
I am an author on this paper
Click your name to claim this paper and add it to your profile.
Reviews
Recommended
No Data Available