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. 2021 Jul 21;12(32):10883–10892. doi: 10.1039/d1sc02769g

Fig. 2. (a) Comparison of the carboboration pathway and the B(C6F5)3-catalyzed hydrosilylation of alkyne. Performed at the M06-2X/cc-pVTZ/(PCM, CH2Cl2)//M06-2X/6-311G(d,p)/(PCM, CH2Cl2) level of theory (energies are in kcal mol−1); (b) optimized structures and NPA charges for ion-pair species II (with Me3SiH) and II′ (with Me2SiH2).

Fig. 2