Table 2.
Experiments | Modeling | ||||
---|---|---|---|---|---|
Temperature (K) | ΔH (kJ mol−1) |
ΔS (J K−1 mol−1) |
Structure (see Figure 5) |
ΔH (kJ mol−1) |
ΔS (J K−1 mol1) |
293.15–299.82 | 15.79 ± 0.7 | 133.56 ± 6 | closed | 8.43 | 126.11 |
303.15–313.15 | −210.66 ± 1.7 | −614.57 ± 12 | opened | −154.42 | −214.67 |
ΔH and ΔS are the enthalpy change and entropy change, respectively.