Title: An experimental and computational IR and hybrid DFT-D3 study of the conformations of l-lactic and acrylic acid: new insight into the dehydration mechanism of lactic acid to acrylic acid

Authors (2): C. D. Zeinalipour-Yazdi, C. R. A. .Catlow

Themes: Design (2019)

DOI: 10.1039/c9cp02968k

Citations: 5

Pub type: article-journal

Publisher: Royal Society of Chemistry (RSC)

Issue: 40

License: http://rsc.li/journals-terms-of-use

Publication date(s): 2019/10/16 (print) 2019 (online)

Pages: 22331-22343

Volume: 21 Issue: 40

Journal: Physical Chemistry Chemical Physics

Link: http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP02968K

URL: http://dx.doi.org/10.1039/c9cp02968k

Effect of the intra-molecular H-bond of l-lactic acid on its dehydration mechanism: IR and DFT-D3 study,

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