| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5395137 | Computational and Theoretical Chemistry | 2011 | 6 Pages |
Abstract
⺠NLO properties of series of anilines and N,N-dimethylanilines were calculated. ⺠Dipole moment, polarizability, hyperpolarizability and optical band gap were examined. ⺠Studied effect of solvent, donor, acceptor, substituent and conjugation length. ⺠Strong donor-acceptor intramolecular charge transfer interaction most important. ⺠(CH3)2N as donor and vinyl nitro group para resulted in strongest β value.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Mazharul M. Islam, M. Delower H. Bhuiyan, Thomas Bredow, Andrew C. Try,