Open AccessIsomerization and Fragmentation Reactions on the [C2SH4] Potential Energy Surface: The Metastable Thione S-Methylide Isomer
Author(s) -
Zoi Salta,
Marc E. Segovia,
Aline Katz,
Nicola Tasinato,
Vincenzo Barone,
Oscar N. Ventura
Publication year - 2021
Publication title -
the journal of organic chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.2
H-Index - 228
eISSN - 1520-6904
pISSN - 0022-3263
DOI - 10.1021/acs.joc.0c02835
Subject(s) - thiirane , chemistry , transition state , potential energy surface , density functional theory , singlet state , photochemistry , computational chemistry , isomerization , conical intersection , ab initio , excited state , ring (chemistry) , organic chemistry , molecule , catalysis , atomic physics , physics
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