New insights into small molecule activation by acyclic silylenes: a computational investigation

Nishamol Kuriakose, Kumar Vanka
2014 Dalton Transactions  
The Schemes discussed in the manuscript. 5 Scheme S1 The free energy profile obtained for the ring formation reaction of III with -CH 3 group on the ligand; all values are in kcal/mol. 10 15 Scheme S2 The free energy profile obtained for the ring formation reaction of I by the amido Dipp isopropyl C-H bond activation; all values are in kcal/mol. 20 Electronic Supplementary Material (ESI) for Dalton Transactions This journal is Scheme S3 The free energy profile obtained for the ring formation
more » ... ction of I by the boryl Dipp isopropyl C-H bond activation; all values are in kcal/mol. 10 15 Scheme S4 The free energy profile obtained for the ring formation reaction of II by the amido Dipp isopropyl C-H bond activation; all values are in kcal/mol. 20 Electronic Supplementary Material (ESI) for Dalton Transactions This journal is
doi:10.1039/c3dt52817k pmid:24292330 fatcat:dywl5qbm7ffpdjlajjcv5hfl2q