Kinetics Database Logo     Home
©NIST, 2022
Accessibility information
Kinetics Database Resources

Simple Reaction Search

Search Reaction Database

Search Bibliographic Database

Set Unit Preferences

Contact Us to Submit an Article

Citation

Help


Other Databases

NIST Standard Reference Data Program

NIST Chemistry Web Book

NDRL-NIST Solution Kinetics Database

NIST Computational Chemistry Comparison and Benchmark Database

The NIST Reference on Constants, Units, and Uncertainty

More...


Administrative Links

DOC home page

NIST home page

MML home page

Chemical Sciences Division

Applied Chemicals and Materials Division

Author(s):   Wang, H.M.; Wang, Y.; Han, K.L.; Peng, X.J.
Title:   A DFT study of Diels-Alder reactions of o-quinone methides and various substituted ethenes: Selectivity and reaction mechanism
Journal:   J. Org. Chem.
Volume:   70
Page(s):   4910 - 4917
Year:   2005
Reference type:   Journal article
Squib:   2005WAN/WAN4910-4917

Reaction:   2-Methylene-3,5-cyclohexadiene-1-one + CH2=CHOCH3 → 2H-1-Benzopyran, 3,4-dihydro-, 3-methoxy
Reaction order:   2
Rate expression:   no rate data available
Category:  Theory
Data type:   Ab initio
Comments:   Reaction potential energy surface was studied using quantum chemistry. No rate constant values were calculated.

View full bibliographic record.