Structural, spectroscopic, and photochemical study of ethyl propiolate isolated in cryogenic argon and nitrogen matrices

Ethyl propiolate (HC ≡ CCOOCH2CH3, EP) was studied experimentally by infrared spectroscopy in argon and nitrogen cryomatrices (15 K) and by quantum chemical calculations (at the DFT(B3LYP) and MP2 levels of theory). Calculations predict the existence of four conformers: two low-energy conformers (I...

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Bibliographic Details
Main Author: Lopes, S. (author)
Other Authors: Nikitin, Timur (author), Rui Fausto (author)
Format: article
Language:eng
Published: 2020
Subjects:
Conformational analysis
Ethyl propiolate
Matrix isolation infrared spectroscopy
Photochemistry
Online Access:http://hdl.handle.net/10316/91163
Country:Portugal
Oai:oai:estudogeral.sib.uc.pt:10316/91163

Internet

http://hdl.handle.net/10316/91163

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