Theoretical investigation of the IR spectrum of 5-bromo-2,4 -pentadiynenitrile (BrC5N) in the region between 50 to 4500 cm-1 from a CCSD(T)/B3LYP anharmonic potential
Pouchan, Claude, Karamanis, panagiotis, Dargelos, AlainLanguage:
english
Journal:
ChemPhysChem
DOI:
10.1002/cphc.201701322
Date:
January, 2018
File:
PDF, 1.10 MB
english, 2018