Transition State Calculation for SN2 reaction
- An energy slider and structure of each molecule is present in the simulation's table.
- Adjust relative energy for each molecule present in Reactants, Transition State and Products, such that you obtain an ideal state vs energy plot.
- Note down these relative values, and compare it with actual values.
- Use mouse/touch to interact with molecule, by rotating, and zooming around it.
- For detailed logs, you can download input and output gaussian files by clicking on the respective buttons and analyze the data.