Matrix isolation FT-IR spectroscopy and molecular orbital study of sarcosine methyl ester
N-methylglycine methyl ester (sarcosine-Me) has been studied by matrix isolation FT-IR spectroscopy and molecular orbital calculations undertaken at the DFT/B3LYP and MP2 levels of theory with the 6-311++G(d,p) and 6-31++G(d,p) basis set, respectively. Twelve different conformers were located in the...
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| Formato: | article |
| Idioma: | eng |
| Publicado em: |
2004
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| Texto completo: | http://hdl.handle.net/10316/5146 |
| País: | Portugal |
| Oai: | oai:estudogeral.sib.uc.pt:10316/5146 |