Table 4.
Method | r(Si-H) | r(Si-F) | ∠(HSiF) | Refs. |
---|---|---|---|---|
a | 1.528(5) | 1.603(3) | 96.9(5) | [52] |
re a | 1.529(6) | 1.603(1) | 96.9(3) | [30] |
MP2/6-311+G(3df,2pd) | 1.5201 | 1.6250 | 96.59 | This work |
MP2/cc-pVTZ b | 1.5230 | 1.6132 | 96.90 | This work |
1.5227(8) | 1.6028(2) | 96.75(8) | This work |
a Derived from the rz structure. b cc-pV(T+d)Z on Si.