How great is the stabilization of crowded polyphenylbiphenyls by London dispersion?
| Autor: | Carlos F. R. A. C. Lima, Joel T. Mague, Yuchen Du, Robert A. Pascal, Luís M. N. B. F. Santos |
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| Rok vydání: | 2023 |
| Předmět: | |
| Zdroj: | Physical Chemistry Chemical Physics. 25:13359-13375 |
| ISSN: | 1463-9084 1463-9076 |
| Popis: | Energetic analyses based on homodesmotic reactions show a surprising ability of crowded biphenyls to achieve significant stabilization through intramolecular dispersive interactions, which is underestimated even by state-of-the-art DFT calculations. |
| Databáze: | OpenAIRE |
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