Research Article

Electronic Structure, Spectroscopic (IR, Raman, UV-Vis, NMR), Optoelectronic, and NLO Properties Investigations of Rubescin E (C31H36O7) Molecule in Gas Phase and Chloroform Solution Using Ab Initio and DFT Methods

Figure 5

Theoretical absorption spectra of Rubescin E at the B3PW91 and B3LYP levels in gas with the 6-311++G(d,p) basis set.