A proposal for an extended dual descriptor: a possible solution when Frontier Molecular Orbital Theory fails

Orbital Theory ◽

Dual Descriptor

Applications of Frontier Molecular Orbital Theory to Pericyclic Reactions

Organic Chemistry: A Series of Monographs - Pericyclic Reactions ◽

10.1016/b978-0-12-470502-9.50010-9 ◽

1977 ◽

pp. 181-271 ◽

Cited By ~ 45

Author(s):

K.N. HOUK

Keyword(s):

Molecular Orbital ◽

Pericyclic Reactions ◽

Synthesis and Properties of Azoles and Their Derivatives. 54. The Regioselectivity of [2+3] Cycloaddition Of C,C,N-Triphenyl- and Z-C,N-Diphenylnitrones With - and α-Substituted Nitroethylenes in Light of Frontier Molecular Orbital Theory

Chemistry of Heterocyclic Compounds ◽

10.1023/b:cohc.0000027893.83553.c2 ◽

2004 ◽

Vol 40 (2) ◽

pp. 203-210

Author(s):

R. Yasinski ◽

A. Tsenzhkovska ◽

A. Lyubimtsev ◽

A. Baranski

Keyword(s):

Molecular Orbital ◽

Frontier molecular orbital theory of cycloaddition reactions

Accounts of Chemical Research ◽

10.1021/ar50095a001 ◽

1975 ◽

Vol 8 (11) ◽

pp. 361-369 ◽

Cited By ~ 528

Author(s):

Kendall N. Houk

Keyword(s):

Molecular Orbital ◽

Cycloaddition Reactions ◽

ChemInform Abstract: FRONTIER MOLECULAR ORBITAL THEORY OF CYCLOADDITION REACTIONS

Chemischer Informationsdienst ◽

10.1002/chin.197610073 ◽

1976 ◽

Vol 7 (10) ◽

pp. no-no

Author(s):

KENDALL N. HOUK

Keyword(s):

Molecular Orbital ◽

Cycloaddition Reactions ◽

Introduction of external field effects in the frontier molecular orbital theory of chemical reactivity

International Journal of Quantum Chemistry ◽

10.1002/qua.560440866 ◽

1992 ◽

Vol 44 (S26) ◽

pp. 751-760 ◽

Cited By ~ 1

Author(s):

Fernando Mendizabal ◽

Renato R. Contreras ◽

Arie J. Aizman

Keyword(s):

External Field ◽

Molecular Orbital ◽

Chemical Reactivity ◽

Orbital Theory ◽

Field Effects ◽

Theory Of Chemical Reactivity

Using Balloons to Model Pi-Conjugated Systems and to Teach Frontier Molecular Orbital Theory

World Journal of Chemical Education ◽

10.12691/wjce-6-2-5 ◽

2018 ◽

Vol 6 (2) ◽

pp. 102-106

Author(s):

Daniel J. Swartling ◽

Janet G. Coonce ◽

Derek J. Cashman

Keyword(s):

Molecular Orbital ◽

Orbital Theory ◽

Conjugated Systems ◽

Pi Conjugated

Beyond Frontier Molecular Orbital Theory: A Systematic Electron Transfer Model (ETM) for Polar Bimolecular Organic Reactions

The Journal of Organic Chemistry ◽

10.1021/jo301731v ◽

2012 ◽

Vol 78 (5) ◽

pp. 1864-1873 ◽

Cited By ~ 12

Author(s):

Katharine J. Cahill ◽

Richard P. Johnson

Keyword(s):

Electron Transfer ◽

Molecular Orbital ◽

Organic Reactions ◽

Transfer Model ◽

A Frontier Molecular Orbital Theory Approach to Understanding the Mayr Equation and to Quantifying Nucleophilicity and Electrophilicity by Using HOMO and LUMO Energies

Asian Journal of Organic Chemistry ◽

10.1002/ajoc.201200103 ◽

2012 ◽

Vol 1 (4) ◽

pp. 336-345 ◽

Cited By ~ 40

Author(s):

Lian-Gang Zhuo ◽

Wei Liao ◽

Zhi-Xiang Yu

Keyword(s):

Molecular Orbital ◽

Theory Approach ◽

Orbital Theory ◽

Homo And Lumo

ChemInform Abstract: Using Perturbation and Frontier Molecular Orbital Theory to Predict Diastereofacial Selectivity

ChemInform ◽

10.1002/chin.199929318 ◽

2010 ◽

Vol 30 (29) ◽

pp. no-no

Author(s):

J. J. Dannenberg

Keyword(s):

Molecular Orbital ◽

Gas-phase rate coefficients for the reactions of O(3P), S(3P), Se(3P), and Te(3P) with alkenes: Application of perturbation frontier molecular orbital theory, correlations, and structure-activity relations (SARs)

International Journal of Chemical Kinetics ◽

10.1002/kin.20156 ◽

2006 ◽

Vol 38 (5) ◽

pp. 351-356 ◽

Cited By ~ 1

Author(s):

Christian Pfrang ◽

Martin D. King ◽

Carlos E. Canosa-Mas ◽

Richard P. Wayne

Keyword(s):

Gas Phase ◽

Molecular Orbital ◽

Rate Coefficients ◽

Orbital Theory ◽

Structure Activity ◽

Structure Activity Relations