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How great is the stabilization of crowded polyphenylbiphenyls by London dispersion?
- Source :
- Physical Chemistry Chemical Physics. 25:13359-13375
- Publication Year :
- 2023
- Publisher :
- Royal Society of Chemistry (RSC), 2023.
-
Abstract
- 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.
- Subjects :
- General Physics and Astronomy
Physical and Theoretical Chemistry
Subjects
Details
- ISSN :
- 14639084 and 14639076
- Volume :
- 25
- Database :
- OpenAIRE
- Journal :
- Physical Chemistry Chemical Physics
- Accession number :
- edsair.doi...........6bee45006c6915a2230ced449d623b1e
- Full Text :
- https://doi.org/10.1039/d2cp05085d