CCL: Transition states vrs reactants
- From: "Richard Tia" <richtiagh---gmail.com>
- Subject: CCL: Transition states vrs reactants
- Date: Mon, 2 Mar 2009 15:05:03 -0500
Sent to CCL by: "Richard Tia" [richtiagh~~gmail.com]
Hi everybody,
To those who have some experience in computing reaction pathways, how would you
rationalize a situation where the 'transition state' is lower in energy than the
reactants? Is this a common occurrence? Could it be that the located TS is for a
side reaction? Could the 'TS' just be an artifact?
I would be very grateful if someone could offer some suggestions as to the
chemistry involved here. Thanks in advance.
Richard Tia
KNUST
Kumasi
Ghana