MNDO-effective charge model study of solvent effect on the potential energy surface of the SN2 reaction

1989 ◽  
Vol 111 (5) ◽  
pp. 1547-1552 ◽  
Author(s):  
Teruya Kozaki ◽  
Kenji Morihashi ◽  
Osamu Kikuchi
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Solvent Effect ◽  
Effective Charge ◽  
Energy Surface ◽  
Sn2 Reaction ◽  
Model Study ◽  
Charge Model

Dynamics of the F− + CH3Cl → Cl− + CH3F SN2 reaction on a chemically accurate potential energy surface

2013 ◽  
Vol 4 (12) ◽  
pp. 4362 ◽  
Author(s):  
István Szabó ◽  
Attila G. Császár ◽  
Gábor Czakó
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Sn2 Reaction

Effect of solvent polarity on the potential energy surface in the SN2 reaction of F− + CH3Cl

2019 ◽  
Vol 1150 ◽  
pp. 18-25
Author(s):  
Lopamudra Satpathy ◽  
Sagarika Sahoo ◽  
Prabhat K. Sahu ◽  
Pradipta K. Behera ◽  
Bijay K. Mishra
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Solvent Polarity ◽  
Effect Of Solvent ◽  
Sn2 Reaction
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