Nota de FísicaPublicado
Revisiting Julg's Structural Approach to Aromaticity
Myriam Segre de Giambiagi; Mario Giambiagi; Aloysio Paiva de Figueiredo
2001
Datos de la publicación
- Autores
- Myriam Segre de Giambiagi; Mario Giambiagi; Aloysio Paiva de Figueiredo
- Tipo
- Nota de Física
- Estado
- Publicado
- Fecha de publicación
- 2001
- Descripción
- Julg's classical formula for aromaticity is updated so as to involve bond indices. A simple CNDO/2 calculation is shown to account satisfactorily for heterocyclic typical rings and other miscellaneous systems. Results are compared with a multicenter MO bond index recently introduced as an aromaticity measure.
- Año
- 2001
- Número
- CBPF-NF-007/01
- Vínculo con tesis
- No
- Vínculo con beca
- No