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1 Molecular Mechanics Template
1 Molecular Mechanics Template
Mechanics Molecular Mechanics
CHEM453‐F22 1 CHEM453‐F22 2
Molecular Mechanics Molecular Mechanics
Conformational analysis‐ acyclic systems Conformational analysis‐ acyclic systems
CHEM453‐F22 3 CHEM453‐F22 4
Molecular Mechanics Molecular Mechanics
Conformational analysis‐ acyclic systems Conformational analysis‐ cyclic systems
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
CHEM453‐F22 5 CHEM453‐F22 6
Molecular Mechanics Molecular Mechanics
Conformational analysis‐ cyclic systems Conformational analysis‐ cyclic systems
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books. Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
CHEM453‐F22 9 CHEM453‐F22 10
Molecular Mechanics Molecular Mechanics
Conformational analysis‐ cyclic systems Conformational analysis‐ cyclic systems
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
CHEM453‐F22 11 CHEM453‐F22 12
Molecular Mechanics Molecular Mechanics
Conformational analysis‐ cyclic systems Conformational analysis‐ cyclic systems
CHEM453‐F22 13 CHEM453‐F22 14
Molecular Mechanics Molecular Mechanics
Conformational analysis‐ cyclic systems Unsaturated molecules strain.
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
Anslyn, E. V., & Dougherty, D. A. (2005). Modern physical organic chemistry. University Science Books.
CHEM453‐F22 15 CHEM453‐F22 16
Molecular Mechanics Molecular Mechanics
Unsaturated molecules strain. Allylic strain (A‐strain).
CHEM453‐F22 17 CHEM453‐F22 18
Molecular Mechanics Molecular Mechanics
1,3‐Allyl strain. Exploiting 1,3‐Allylic strain.
CHEM453‐F22 19 CHEM453‐F22 20