| 1,1-dimethylcyclohexane in gas phase | ||||||||
|---|---|---|---|---|---|---|---|---|
| Conformation | δE | Stat. point | 1,2,3,4 | 2,3,4,5 | 3,4,5,6 | 4,5,6,1 | 5,6,1,2 | 6,1,2,3 |
| C | 0.00 | min | 56.6 | -58.0 | 58.0 | -56.6 | 53.7 | -53.7 |
| TB | 5.09 | min | -65.7 | 31.3 | 31.3 | -65.7 | 31.5 | 31.5 |
| TB | 5.09 | min | 67.5 | -31.3 | -31.3 | 65.7 | -31.5 | -31.5 |
| TB | 6.12 | min | 44.1 | -63.3 | 20.0 | 39.4 | -58.4 | 14.8 |
| TB | 6.12 | min | -44.1 | 63.3 | -20.0 | -39.7 | 58.4 | -14.8 |
| B | 6.51 | saddle | 56.3 | -56.6 | 3.9 | 49.9 | -50.0 | -3.2 |
| B | 9.99 | saddle | -2.0 | 48.7 | -48.7 | 2.0 | 44.0 | -44.0 |
| half-C | 10.98 | saddle | 13.9 | 14.8 | -40.0 | -1.5 | 67.5 | -53.4 |
| half-C | 10.98 | saddle | -13.9 | -14.8 | 40.0 | 1.5 | -67.5 | 53.4 |
| half-C | 11.19 | saddle | -5.6 | -30.7 | 66.5 | -66.9 | 30.2 | 5.9 |
| half-C | 11.19 | saddle | 5.6 | 30.7 | -66.5 | 66.9 | -30.2 | -5.9 |
| half-C | 12.12 | saddle | -65.8 | 33.6 | 3.1 | -10.1 | -20.1 | 58.3 |
| half-C | 12.12 | saddle | 65.8 | -33.6 | -3.1 | 10.1 | 20.1 | -58.3 |