The photodissociation of solvated cyclopropanone and its hydrate explored <i>via</i> non-adiabatic molecular dynamics using ΔSCF-Reference-Cited by-同舟云学术

The photodissociation of solvated cyclopropanone and its hydrate explored via non-adiabatic molecular dynamics using ΔSCF

Published:2022 Issue:9 Volume:24 Page:5669-5679
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Vandaele Eva¹^ORCID,Mališ Momir¹,Luber Sandra¹^ORCID

Affiliation:

1. Department of Chemistry, University of Zürich, Winterthurerstrasse 190, 8057 Zürich, Switzerland

Abstract

The lifetime and photodissociation of cyclopropanone are reduced in aqueous solution, while the excitation of solvated cyclopropanone hydrate yields a range of photoproducts.

Funder

Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D1CP05187C

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5. The mechanism of the Favorski reaction

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