Thermochemistry of Small Organosulfur Compounds from ab Initio Calculations
Author:
Affiliation:
1. Centro de Investigação em Química, Departamento de Química, Faculdade de Ciências, Universidade do Porto, Rua do Campo Alegre 687, P-4169-007 Porto, Portugal
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp046993v
Reference55 articles.
1. Gas Phase Reactions of Methyloxirane with HO- and Methylthiirane with HO- and HS-. An Ab Initio Study of Addition and Elimination
2. The Relative Reactivity of Thioethers and Sulfoxides toward Oxygen Transfer Reagents: The Oxidation of Thianthrene 5-Oxide and Related Compounds by MoO5HMPT
3. The Regioselective Reaction of Atomic Hydrogen with Unsymmetric Disulfides and Sulfides
4. Rotational spectra, internal rotation analysis, dipole moment and structure of methylthiirane
5. Gaussian-2 theoretical and direct ab initio molecular dynamics study of the reaction of O(3P) with thiirane, O(3P)+C2H4S(1A1)→SO(3Σ-)+C2H4(1Ag)
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