DFT computational schemes for 15 N NMR chemical shifts of the condensed nitrogen-containing heterocycles
© 2019 John Wiley & Sons, Ltd.
| Publié dans: | Magnetic resonance in chemistry : MRC. - 1985. - 57(2019), 7 vom: 15. Juli, Seite 346-358 |
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| Auteur principal: | |
| Autres auteurs: | , |
| Format: | Article en ligne |
| Langue: | English |
| Publié: |
2019
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| Accès à la collection: | Magnetic resonance in chemistry : MRC |
| Sujets: | Journal Article 15N NMR DFT functionals GIAO-DFT basis sets condensed nitrogen-containing heterocycles locally dense basis set scheme substitution effects |
| Accès en ligne |
Volltext |