Fig. 2
HOMO and LUMO of neutral and protonated form of investigated compounds in gas and aqueous phase. Generated using GaussView 5.0 (Gaussian, Inc., Wallingford, CT, USA; https://gaussian.com/
Fig. 2 | Scientific Reports
HOMO and LUMO of neutral and protonated form of investigated compounds in gas and aqueous phase. Generated using GaussView 5.0 (Gaussian, Inc., Wallingford, CT, USA; https://gaussian.com/
