| Ep | Ea | Ec | VEAs0 | VIPs0 | ||
| δ-OsCl2(Azpy)2 | Vacuum | −1298.545 | −1298.636 | −1298.324 | −2.476 | 5.992 |
| Water | −1298.571 | −1298.715 | −1298.382 | −3.907 | 5.156 | |
| DMSO | −1298.571 | −1298.714 | −1298.381 | −3.900 | 5.154 | |
| Diethylether | −1298.564 | −1298.690 | −1298.366 | −3.412 | 5.385 | |
| Benzene | −1298.556 | −1298.670 | −1298.353 | −3.096 | 5.526 |