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Reaction of Stabilized Criegee Intermediates from Ozonolysis of Limonene with Water: Ab Initio and DFT Study
The mechanism of the chemical reaction of H(2)O with three stabilized Criegee intermediates (stabCI-OO, stabCI-CH(3)-OO and stabCIx-OO) produced via the limonene ozonolysis reaction has been investigated using ab initio and DFT (Density Functional Theory) methods. It has been shown that the formatio...
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| Main Authors: | , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Molecular Diversity Preservation International (MDPI)
2013
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3634429/ https://ncbi.nlm.nih.gov/pubmed/23481640 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms14035784 |
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