Table 1.
Energy and kinetic energy stabilizations for A–H bonds (in kcal/mol).
H–H | Li–H | [Be–H]+ | HBe–H | B–H | C–H | |
---|---|---|---|---|---|---|
ΔEPrep | 0.0 | 0.0 | 0.0 | 0.0 | 12.6 | 16.4 |
ΔECov | −66.0 | −16.8 | −19.2 | −62.7 | −35.4 | −16.9 |
ΔECon | −20.9 | −2.2 | −6.8 | −11.4 | −15.1 | −19.6 |
ΔEPCT | −8.4 | −25.5 | −32.4 | −9.1 | −22.9 | −32.1 |
ΔTPrep | 0.0 | −0.3 | 0.7 | −4.3 | −15.0 | −17.2 |
ΔTCov | −97.0 | −0.7 | 7.2 | −31.1 | −62.2 | −93.1 |
ΔTCon | 182.6 | 38.7 | 76.0 | 94.5 | 113.7 | 124.3 |
ΔTPCT | 17.8 | 12.1 | −9.5 | 34.6 | 51.1 | 72.5 |