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Computational Study of Electron Delocalization in Hexaarylbenzenes
A number of hexaarylbenzene compounds were studied theoretically, in order to compare energy changes as a result of the toroidal delocalization effect that is characteristic of all these species. The energy was studied taking advantage of locally designed isodesmic reactions. Results indicate that t...
Tallennettuna:
| Julkaisussa: | Molecules |
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| Päätekijät: | , |
| Aineistotyyppi: | Artigo |
| Kieli: | Inglês |
| Julkaistu: |
MDPI
2014
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| Aiheet: | |
| Linkit: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6271654/ https://ncbi.nlm.nih.gov/pubmed/24642912 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules19033274 |
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