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. 2013 Nov 19;69(Pt 12):2534–2542. doi: 10.1107/S0907444913025997

(b).

Energetics derived from fitting the TSE to the temperature dependence of selected microscopic rate coefficients (the errors from the fit are given in parentheses).

Microscopic rate coefficients k 3 k 4 k 5 k 8
ΔH # (kJ mol−1) 24.7 48.1 50.0 75.2 (0.03)
ΔS # (J mol−1 K−1) −9.4 −10.2 −14.8 41.9 (0.08)
TΔS # (kJ mol−1) −2.8 −3.1 −4.5 12.6 (0.02)
ΔG # (kJ mol−1) 27.5 51.2 54.5 62.7 (0.09)