Impact Factor: 5.6     h-index: 27

Computational Investigation of β-hydrogen Elimination in the (C2X5)2B(C2H5); X=H, F, Cl, Br Molecules
Computational Investigation of β-hydrogen Elimination in the (C2X5)2B(C2H5); X=H, F, Cl, Br Molecules

Saideh Ghorbaninezhad; Reza Ghiasi

Volume 4, Issue 1 , January and February 2020, , Pages 80-91

https://doi.org/10.33945/SAMI/CHEMM.2020.1.7

Abstract
  In this paper, the DFT methods were applied at the M06-2X/6–311++G(d,p) levels of theory to investigate the β-hydrogen elimination in the (C2X5)2B(C2H5); X=H, F, Cl, Br. ...  Read More