Table 3.
Catalyst | Calculated[a] %ee |
Experimental %ee |
---|---|---|
7 | 62 | 80 |
8 | 51 | 74 |
9 | 80 | 93 |
M06-2X/6-31+G(d,p),CPCM(MeOH)//B3LYP/6-31G(d), CPCM(MeOH).
Catalyst | Calculated[a] %ee |
Experimental %ee |
---|---|---|
7 | 62 | 80 |
8 | 51 | 74 |
9 | 80 | 93 |
M06-2X/6-31+G(d,p),CPCM(MeOH)//B3LYP/6-31G(d), CPCM(MeOH).