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Talk:Mod:DV2412

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Comments

Cyclopentadiene

Values are all correct. Great discussion!

Figures would have been a nice addition to the discussion of transition states etc, but good.

Taxol

It may have been nice to see all of the possible conformations modelled to confirm what you say, but otherwise good.

Values aren't quite right - check the conformations of the chair are exact! Still correct conclusions and a great discussion.

NMR

1H NMR - great!

13C NMR- What about the sulfur atoms? These need to be corrected for so could explain differences?

Epoxide

Crystal structure

Great, lots of good information.

NMR

Nice. Good use of figures too.

Rotations

Great! Nice lit refs!

TS

Where are your free enery calcs? You must have done them, so it would have been nice to see them!

Good conclusion.

QTAIM and NCI

Nicely done

Suggestion

Good, but tetra substituted alkenes are very hard to epoxidise!