Unveiling the conformational diversity of succinic acid: Insights from IR spectroscopy and quantum chemical calculations

Small α-dicarbonyl compounds like succinic acid are found abundantly in the atmosphere, thereby contributing to the formation of secondary organic aerosols through solid or liquid particles and gas-phase molecular clusters. The vibrational spectrum of succinic acid was measured in two different environments to evidence the role of the medium on the geometry adopted by the acid. Different structures were observed. The planar and extended structures of succinic acid were favored in the solid state whereas the non-planar gauche conformer was the predominant form in an argon matrix at 20 K, similar to the gas phase. Aided by quantum chemistry calculations and the non-covalent interactions analysis, we investigated the conformational diversity of succinic acid to understand the factors that govern the stability of the acid.

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Publication Details

Journal
Low Temperature Physics
Published
2024-09-01
DOI
https://doi.org/10.1063/10.0028183
Citations
2
Primary Topic
Analytical Chemistry and Chromatography
Type
article
Field-Weighted Citation Impact
0.48

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article

Unveiling the conformational diversity of succinic acid: Insights from IR spectroscopy and quantum chemical calculations

Katia Le Barbu‐Debus, Ander Camiruaga, Jordan A. Claus, Rodolphe Pollet et al.
2 citations
Low Temperature Physics
Analytical Chemistry and Chromatography
0.48
article

Unveiling the conformational diversity of succinic acid: Insights from IR spectroscopy and quantum chemical calculations

Katia Le Barbu‐Debus, Ander Camiruaga, Jordan A. Claus, Rodolphe Pollet, Wutharath Chin, Lucas Gonçalves da Silva, Manuel Goubet
article en
2 citations

Abstract

Small α-dicarbonyl compounds like succinic acid are found abundantly in the atmosphere, thereby contributing to the formation of secondary organic aerosols through solid or liquid particles and gas-phase molecular clusters. The vibrational spectrum of succinic acid was measured in two different environments to evidence the role of the medium on the geometry adopted by the acid. Different structures were observed. The planar and extended structures of succinic acid were favored in the solid state whereas the non-planar gauche conformer was the predominant form in an argon matrix at 20 K, similar to the gas phase. Aided by quantum chemistry calculations and the non-covalent interactions analysis, we investigated the conformational diversity of succinic acid to understand the factors that govern the stability of the acid.

Low Temperature PhysicsVol. 50(9)
Centre National de la Recherche Scientifique (FR), Université de Lille (FR), Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR), Université Paris-Saclay (FR), Institut des Sciences Moléculaires d'Orsay (FR), CEA Paris-Saclay (FR), Laboratoire de Physique des Lasers, Atomes et Molécules (FR)
Agence Nationale de la Recherche, Centre National de la Recherche Scientifique, Laboratoire d’excellence Physique Atomes Lumière Matière
Openalex Percentile: Top 41%
Analytical Chemistry and Chromatography
0.48
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