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. 2007 Oct 26;3:36. doi: 10.1186/1860-5397-3-36

Figure 1.

Figure 1

Transition structure for the energetically favored trans to phosphorus addition of ammonia at the Pd-η3-allylic intermediate (B3LYP/6-31G* (C, H, N, P, O), /SDD (Pd)). Bond distances are given in Å.