“…Pyrrole moiety is the structural core of the naturallyoccurring porphyrins, the tetrapyrrolic ''pigments of life'', which include the hemoglobin, porphyrins, corrins, vitamin B 12 , the bile pigments and chlorophyll, playing an important role in respiration and photosynthesis processes [14][15][16][17][18]. Moreover, pyrrole and derivatives scaffolds are widely used as precursors in the synthesis of drugs with high therapeutical potential [19][20][21][22][23][24][25][26][27][28][29][30], polymers and new materials [31][32][33][34][35][36][37]. In this context, the knowledge of the molecular energetics of the core units is of great importance to understand the activity and the chemical behaviour of larger molecules involving them.…”