Skip to main content
. 2021 Oct 12;60(46):24395–24399. doi: 10.1002/anie.202109744

Figure 2.

Figure 2

DFT‐computed reaction pathways for the formation of pyrazole‐alkylated compound from the reaction of methyl (E)‐2‐diazo‐4‐phenylbut‐3‐enoate (1 b) with aryl ester (2 b) calculated using the SMD/M06‐2X‐D3/def2‐TZVP//SMD/ M06‐2X/ 6‐31G(d) level of theory in CH2Cl2. Energies given in kcal mol−1. Ar=p‐FC6H4.