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32744461475
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note
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60-diazomethane reaction, in the stepwise mode 1, ionic TS1, ionic Int, and ionic TS2 have been found to have activation energies of, respectively, 37.12, 16.76 and 26.44 kcals/mol.
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95
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32744466991
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note
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60-diazomethane reaction, in the stepwise mode 1, for the biradical path, biradical TS1, biradical Int, and biradical TS2 have been found to have activation energies in toluene of 32.04, 8.76, and 23.99 kcals/mol, respectively. For the same reaction in the ionic path, ionic TS1, ionic Int, and ionic TS2 have been found to have activation energies in toluene 39.89, 17.59, and 27.83 kcals/mol, respectively.
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