THEORETICAL EVALUATION OF THE AROMATIC CHARACTER OF AZA-PHOSPHA-CORONENES
Three aza-phospha-compounds, derivatives of coronenes with N and P atoms in ortho, meta and para positions, were proposed. Their possible aromatic character was evaluated by means of local and global aromaticity indices like HOMA, NICS, PDI and HOMO-LUMO gap. The influence of the heteroatom has bee...
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| Principais autores: | , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
Babes-Bolyai University
2015-03-01
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| Series: | Studia Universitatis Babes-Bolyai Chemia |
| Assuntos: | |
| Acceso en liña: | https://studia.reviste.ubbcluj.ro/index.php/chemia/article/view/8417 |
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