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. 2020 Jul 21;5(30):18746–18757. doi: 10.1021/acsomega.0c01760

Table 4. Second-Order Rate Constants, Eigenvalues of the Association Probability Matrix, and Relative Nucleophilicity of Reactants (ET – in Ethanol, NM – in Nitromethane).

reactant k, L·mol–1·s–1 NM k, L·mol–1·s–1 ET λVDW NM λVDW ET Nrel NM Nrel ET
2a 3.6452 1.0214 76.24 124.87 0.3889 –0.1165
2b 2.5129 1.0210 66.94 100.29 0.2417 –0.2980
2c 0.5157 0.1283 69.40 99.78 –0.0292 –0.6281
2d 0.6780 0.1505 81.08 118.67 –0.1550 –0.8455
2e 0.4873 0.1121 86.05 132.63 –0.3136 –0.9671
2f 0.5605 0.2564 76.20 107.34 –0.1769 –0.7013
2g 0.3068 0.0231 87.11 119.34 –0.7958 –1.3765
2h 0.7670 0.3868 68.52 100.81 0.2019 –0.3246
2i 0.8522 0.2855 72.22 103.02 –0.1086 –0.6986
2j 0.4670 0.1305 81.90 104.11 –0.3933 –0.9543
2k 1.7946 0.6180 105.32 168.72 0.2470 –0.2940
2l 2.7190 1.0127 91.89 129.95ss 0.1919 –0.2774
2m 0.7910 0.2608 100.34 150.04 0.2174 –0.2456