Intermolecular non-covalent interactions revealed by broadband rotational spectroscopy
Sanz, M. Eugenia
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https://hdl.handle.net/2142/104395
Description
Title
Intermolecular non-covalent interactions revealed by broadband rotational spectroscopy
Author(s)
Sanz, M. Eugenia
Contributor(s)
Tang, Jackson
Alonso, Elena R.
Peña, Isabel
Loru, Donatella
Burevschi, Ecaterina
Saxena, Shefali
Murugachandran, S. Indira
Issue Date
2019-06-18
Keyword(s)
Non-covalent interactions
Date of Ingest
2019-07-15T22:16:50Z
2020-01-25T19:31:00Z
Abstract
Non-covalent interactions play a key role in chemistry, physics and biology, being responsible for the three-dimensional structure of proteins, the physical properties of condensed phases, and the outcome of molecular recognition processes, to cite just a few examples. In this talk we will focus on intermolecular non-covalent interactions and present our results on several complexes investigated by chirped pulsed Fourier transform microwave spectroscopy and computational methods. A range of clusters, involving odorants, aromatic hydrocarbons, alcohols and water will be reviewed. The interplay between primary and secondary hydrogen bonds and/or dispersion forces will be discussed, as well as the performance of several theoretical methods in view of the experimental data.
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