A QM/MM study of the asymmetric dihydroxylation of terminal aliphatic n-alkenes with OsO₄·(DHQD)₂PYDZ: Enantioselectivity as a function of chain length

Keyphrases

• Enantioselectivity 100%
• Sharpless Asymmetric Dihydroxylation 100%
• Enantiomeric Excess 100%
• QM-MM 100%
• 1-octene 100%
• Chain Length 100%
• 1-butene 100%
• N-alkanes 100%
• Transition State 50%
• Alkenes 50%
• Short Chain 50%
• Dihydroxylation 50%
• Relevant Region 50%
• R-enantiomer 50%
• Total Energy 50%
• Pyridazine 50%
• Propene 50%
• 1-hexene 50%
• 1-pentene 50%
• Hexene-1 50%
• Systematic Treatment 50%
• Long-chain Alkanes 50%
• 1-Heptene 50%
• 1-decene 50%
• Nonene 50%

Chemistry

• Alkene 100%
• Enantioselectivity 100%
• Asymmetric Dihydroxylation 100%
• Enantiomer 50%
• Transition State 25%
• Propene 25%
• Octene 25%
• Dihydroxylation 25%
• Hybrid QM/MM 25%
• Conformational Isomer 25%
• Pyridazine 25%
• 1-Hexene 25%
• R Isomer 25%
• 1-Decene 25%
• 1-Nonene 25%
• Butene 25%

Chemical Engineering

• Olefin 100%
• Propylene 25%
• Butene 25%