Quantum Mechanical Approach to Leucine + OH Gas Phase Reaction. Mechanism and Kinetics
The gas phase OH hydrogen abstraction reaction fromleucine has been studied using Density Functional Theory (B3LYP)calculations and the 6-311G(d,p) basis set. The structures of the differentstationary points are discussed. Reaction profiles are modeledincluding the formation of pre-reactive complexe...
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| Vydáno v: | Journal of the Mexican Chemical Society |
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| Hlavní autoři: | , , , |
| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
Sociedad Química de México
2004
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| Témata: | |
| On-line přístup: | https://www.redalyc.org/articulo.oa?id=47548206 |
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