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How is the enantiomeric excess (ee) of the product calculated in the ML3 model?

OpenAI's Answer

To calculate the enantiomeric excess (ee) of a product, you can use the formula:

[ \text{ee} = \left(\frac{[R] - [S]}{[R] + [S]}\right) \times 100% ]

where ([R]) and ([S]) are the concentrations of the two enantiomers in the sample. This formula measures the purity or excess of one enantiomer compared to the other. A racemic mixture has an ee of 0%, while a pure enantiomer has an ee of 100%.

For more information, you can refer to the detailed guide on calculating enantiomeric excess here.

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