Difference between revisions of "Hannah"

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Proton NMR (Hartree-Fock)
 
Proton NMR (Hartree-Fock)
  
[[File:plot.png|300px]]
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[[File:nmrEnol.png|300px]]

Revision as of 18:14, 15 April 2021

Tautomers of Acetylacetone (C5H8O2)

Usually the keto tautomer is favored Keto = ketone Enol = alcohol

may also be referred to as an alkenol

Keto Acetylacetone

With geometry optimization

Molecule (2).png

PubChem's 3D structure has both oxygens pointing in the same direction

Error creating thumbnail: File missing

Proton NMR (Hartree-Fock)

NmrKeto.png

Enol Acetylacetone

Molecule.png

Proton NMR (Hartree-Fock)

NmrEnol.png