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. Author manuscript; available in PMC: 2016 Dec 7.
Published in final edited form as: Org Lett. 2016 Mar 16;18(7):1538–1541. doi: 10.1021/acs.orglett.6b00278

Figure 2.

Figure 2

Computational analysis of the cycloaddition of 2-acetamido-N-methylacrylamide with N-methyl-2-diazoacetamide. Optimized geometries and free energies were calculated at the M06-2X/6-31+G(2d,p) level of theory. Energies include solvation corrections (water) on gas-phase geometries using IEFPCM model (radii=UFF).