Article ID Journal Published Year Pages File Type
1411906 Journal of Molecular Structure 2007 8 Pages PDF
Abstract
Vibrational spectra of trans-N,N′-bis-(R-salicylidene)-cyclohexanediamine (R = H, 5-NO2, 4,6-OCH3, 3,5-Cl) and its analogues deuterated in OH and imine CH groups were calculated using DFT method at 6-31G** level. The presence of strong coupling in the molecules was evidenced.
Related Topics
Physical Sciences and Engineering Chemistry Organic Chemistry
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