Probing hyperconjugative aromaticity of cyclopentadiene and pyrroliums containing groups 13, 15, and 16 substituents
Theoretical calculations demonstrate that group 13 substituents can induce hyperconjugative aromaticity whereas groups 15 and 16 substituents result in nonaromaticity due to their high electronegativity in most cases.
Authors
- Jun Zhu (ORCID: https://orcid.org/0000-0002-2099-3156)
- Fangzhou Xu (ORCID: https://orcid.org/0000-0001-6788-7820)
- Jun Wei Yan (ORCID: https://orcid.org/0000-0001-9966-4357)
- Zijie Qiu (ORCID: https://orcid.org/0000-0003-0728-1178)
- Jiaying Su
Institutions
- Xiamen University (CN)
- Chinese University of Hong Kong, Shenzhen (CN)
- Collaborative Innovation Center of Chemistry for Energy Materials (CN)
Publication Details
- Journal
- New Journal of Chemistry
- Published
- 2024-12-27
- DOI
- https://doi.org/10.1039/d4nj04234d
- Primary Topic
- Synthesis and Properties of Aromatic Compounds
- Type
- article
- Field-Weighted Citation Impact
- 0.00
Funders
- Science and Technology Foundation of Shenzhen City
- National Natural Science Foundation of China