Raman spectroscopic evidence for cooperative C-H...O interactions in the Acetaldehyde-CO2 complex

In carbonyl compounds having a hydrogen atom attached to the alpha-carbon or directly to the carbonyl carbon, our recent ab initio and solvation studies have predicted the presence of a weak C-H...O interaction with CO2. This intermolecular interaction acts cooperatively with the Lewis acid-Lewis ba...

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Veröffentlicht in:Journal of the American Chemical Society 2002-12, Vol.124 (50), p.14818-14819
Hauptverfasser: BLATCHFORD, Marc A, RAVEENDRAN, Poovathinthodiyil, WALLEN, Scott L
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RAVEENDRAN, Poovathinthodiyil
WALLEN, Scott L
description In carbonyl compounds having a hydrogen atom attached to the alpha-carbon or directly to the carbonyl carbon, our recent ab initio and solvation studies have predicted the presence of a weak C-H...O interaction with CO2. This intermolecular interaction acts cooperatively with the Lewis acid-Lewis base interaction that exists between CO2 and the carbonyl group. This communication provides the first experimental evidence for this cooperative interaction in the acetaldehyde-CO2 complex using Raman spectroscopy at 25.0 degrees C in the gas phase. The implications of these interactions in the solvation of carbonyl-based CO2-philes are also discussed.
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subjects Atomic and molecular physics
Exact sciences and technology
Molecular properties and interactions with photons
Molecular spectra
Physics
Raman and rayleigh spectra (including optical scattering)
title Raman spectroscopic evidence for cooperative C-H...O interactions in the Acetaldehyde-CO2 complex
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