Solvent effects on the internal rotation barrier around the C-N bond and 14N NMR shielding of 2-amino-3-mercapto propionamide: Continuous set of gauge transformation calculations using a polarisable continuum model

Autor: Shabani, M., Majid Monajjemi, Aghai, H.
Zdroj: Scopus-Elsevier
Databáze: OpenAIRE