Theoretical characterization of electronic structures and properties of C-F···H-C pseudohydrogen bonds

The weak intermolecular interactions between 2-F-tetrahydrofuran and imidazole, pyrimidine, adenine, and guanine were studied theoretically using density functional B3LYP/6-311++G** and HF/6-311++G** methods. The results showed that both conventional N...H hydrogen bond and C-F...H-C pseudohydrogen ... View More