Prediction of solvent effect on the reaction rate andendo/exo selectivity of a Diels-Alder reaction using molecular surface electrostatic potential

Journal of Physical Organic Chemistry ◽

10.1002/poc.647 ◽

2003 ◽

Vol 16 (7) ◽

pp. 369-372 ◽

Author(s):

M. R. Gholami ◽

B. A. Talebi

Keyword(s):

Solvent Effect ◽

Electrostatic Potential ◽

Reaction Rate ◽

Alder Reaction ◽

Diels Alder ◽

Molecular Surface ◽

Diels Alder Reaction ◽

Surface Electrostatic Potential

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Solvent effect in the Diels-Alder reaction

Journal of Molecular Structure ◽

10.1016/0022-2860(83)90405-2 ◽

1983 ◽

Vol 93 ◽

pp. 255-260 ◽

Author(s):

L. Pardo ◽

V. Branchadell ◽

A. Oliva ◽

J. Bertrán

Keyword(s):

Solvent Effect ◽

Alder Reaction ◽

Diels Alder ◽

Diels Alder Reaction

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An Experimental Study of the Solvent Effect on Rate and Selectivity in a Concentrated Diels−Alder Reaction

Organic Process Research & Development ◽

10.1021/op990050s ◽

1999 ◽

Vol 3 (6) ◽

pp. 471-475 ◽

Author(s):

Madoc Sheehan ◽

Paul Sharratt

Keyword(s):

Experimental Study ◽

Solvent Effect ◽

Alder Reaction ◽

Diels Alder ◽

Diels Alder Reaction

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Solvent effect on Hetero-Diels-Alder reaction of isoselenazole with symmetrical acetylenic dienophiles: A MEDT study

Computational and Theoretical Chemistry ◽

10.1016/j.comptc.2019.03.007 ◽

2019 ◽

Vol 1154 ◽

pp. 17-25 ◽

Author(s):

Abdelilah Benallou

Keyword(s):

Solvent Effect ◽

Alder Reaction ◽

Diels Alder ◽

Diels Alder Reaction

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ChemInform Abstract: Solvent Effect as the Result of Frontier Molecular-Orbital Interaction. Part 3. Hetero Diels-Alder Reaction with Inverse Electron Demand Between 4-Arylidenepyrazol-5-ones and Isobutyl Vinyl Ether.

10.1002/chin.198946075 ◽

1989 ◽

Vol 20 (46) ◽

Author(s):

M. BURDISSO ◽

G. DESIMONI ◽

G. FAITA ◽

P. RIGHETTI ◽

G. TACCONI

Keyword(s):

Solvent Effect ◽

Vinyl Ether ◽

Molecular Orbital ◽

Alder Reaction ◽

Diels Alder ◽

Frontier Molecular Orbital ◽

Orbital Interaction ◽

Inverse Electron Demand ◽

Diels Alder Reaction ◽

Electron Demand

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A theoretical study of the solvent effect on Diels-Alder reaction in room temperature ionic liquids using a supermolecular approach

Theoretical Chemistry Accounts ◽

10.1007/s00214-009-0525-0 ◽

2009 ◽

Vol 123 (3-4) ◽

pp. 347-352 ◽

Author(s):

Riccardo Bini ◽

Cinzia Chiappe ◽

Veronica L. Mestre ◽

Christian S. Pomelli ◽

Thomas Welton

Keyword(s):

Ionic Liquids ◽

Solvent Effect ◽

Room Temperature ◽

Theoretical Study ◽

Alder Reaction ◽

Diels Alder ◽

Room Temperature Ionic Liquids ◽

Diels Alder Reaction

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An unusual solvent effect in an intramolecular Diels–Alder reaction

Journal of the Chemical Society Chemical Communications ◽

10.1039/c39860001797 ◽

1986 ◽

pp. 1797-1799 ◽

Author(s):

Sheetal Handa ◽

Keith Jones ◽

Christopher G. Newton

Keyword(s):

Solvent Effect ◽

Alder Reaction ◽

Diels Alder ◽

Diels Alder Reaction

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Dramatic solvent effect on the volume of the Diels-Alder reaction between tetracyanoethylene and cyclopentadiene

Russian Chemical Bulletin ◽

10.1007/bf02494892 ◽

2000 ◽

Vol 49 (6) ◽

pp. 1040-1044 ◽

Author(s):

V. D. Kiselev ◽

E. A. Kashaeva ◽

M. S. Shihab ◽

M. D. Medvedeva ◽

A. I. Konovalov

Keyword(s):

Solvent Effect ◽

Alder Reaction ◽

Diels Alder ◽

Diels Alder Reaction

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Solvent effect as the result of frontier molecular orbital interaction. VII. The retro-diels-alder reaction.

Tetrahedron ◽

10.1016/s0040-4020(01)88725-1 ◽

1992 ◽

Vol 48 (9) ◽

pp. 1667-1674 ◽

Author(s):

G. Desimoni ◽

G. Faita ◽

D. Pasini ◽

P.P. Righetti

Keyword(s):

Solvent Effect ◽

Molecular Orbital ◽

Alder Reaction ◽

Diels Alder ◽

Frontier Molecular Orbital ◽

Orbital Interaction ◽

Diels Alder Reaction

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ChemInform Abstract: Solvent Effect as the Result of Frontier Molecular Orbital Interaction. Part 7. The Retro-Diels-Alder Reaction.

10.1002/chin.199225057 ◽

2010 ◽

Vol 23 (25) ◽

pp. no-no

Author(s):

G. DESIMONI ◽

G. FAITA ◽

D. PASINI ◽

P. P. RIGHETTI

Keyword(s):

Solvent Effect ◽

Molecular Orbital ◽

Alder Reaction ◽

Diels Alder ◽

Frontier Molecular Orbital ◽

Orbital Interaction ◽

Diels Alder Reaction

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“Micellar” catalysis in the aqueous intermolecular diels-alder reaction: rate acceleration and enhanced selectivity

Tetrahedron Letters ◽

10.1016/s0040-4039(00)81800-6 ◽

1983 ◽

Vol 24 (18) ◽

pp. 1897-1900 ◽

Author(s):

Paul A. Grieco ◽

Philip Garner ◽

Zhen-min He

Keyword(s):

Reaction Rate ◽

Alder Reaction ◽

Micellar Catalysis ◽

Diels Alder ◽

Diels Alder Reaction ◽

Rate Acceleration ◽

Enhanced Selectivity

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