Skip to main content
. 2013 May 15;52(11):6260–6272. doi: 10.1021/ic4004824

Table 4. Activation Parameters (ΔH, ΔS, ΔG) for the isomerization of [cis-MCl4(NO)(Hind)] (M = Ru (1), Os(3)) and [trans-MCl4(NO)(Hind)] (M = Ru (2), Os(4)) in C2D2Cl4a.

    ΔH (kJ/mol)
ΔS (J/(mol·K))
ΔG(25 °C) (kJ/mol) ΔG(110 °C) (kJ/mol)
compound process method I method II method I method II method I method I
[cis-RuCl4(NO)(Hind)] (1) cistrans 124.1 ± 0.3 122.8 ± 1.3 –14.9 ± 0.7 –18.7 ± 3.6 128.5 129.8
[trans-RuCl4(NO)(Hind)] (2) transcis 143.7 ± 0.5 138.8 ± 1.0 28.5 ± 1.4 31.0 ± 2.7 135.2 132.8
[cis-OsCl4(NO)(Hind)] (3) cistransb 200.7 ± 0.7   142.7 ± 8.9   161.7 146.0
[trans-OsCl4(NO)(Hind)] (4) transcis 168.2 ± 0.6   85.4 ± 3.9   144.9 135.5
a

Estimation from method I by fitting k1 and k–1 by Eyring equation (eq 5) and by method II, simultaneously fitting the all population ratios at different temperatures via eqs 3 and 4 with constraining eq 5.

b

The kinetic parameters were obtained from reversible first order law analysis of trans to cis conversion data of 4.