Ab Initio Study and Hydrogen Bonding Calculations of Nitrogen and Carbon Chemical Shifts in Serine-Water Complexes
The hydrogen bonding (HB) effects on the NMR shieldingof selected atoms in a few Ser-nH2O complexes have been investigatedwith quantum mechanical calculations of the 15N and 13C tensors.Interaction with water molecules causes important changes in geometryand electronic structure of serine. Chemical...
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| Publicado en: | Journal of the Mexican Chemical Society |
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| Principais autores: | , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
Sociedad Química de México
2005
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| Assuntos: | |
| Acceso en liña: | https://www.redalyc.org/articulo.oa?id=47549409 |
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