Figure 1.
Equilibrium geometries (M06-2X) for (top) singlet 3S and triplet 3T dimethylnitrenium ion and (bottom) singlet 19S and triplet 19T vinylnitrenium ion along with selected geometric parameters.
Equilibrium geometries (M06-2X) for (top) singlet 3S and triplet 3T dimethylnitrenium ion and (bottom) singlet 19S and triplet 19T vinylnitrenium ion along with selected geometric parameters.