PREDICTING HETEROCYCLIC RING COUPLING-CONSTANTS THROUGH A CONFORMATIONAL SEARCH OF TETRA-O-METHYL-(-CATECHIN())

Authors
TOBIASON FL HEMINGWAY RW
Citation
Fl. Tobiason et Rw. Hemingway, PREDICTING HETEROCYCLIC RING COUPLING-CONSTANTS THROUGH A CONFORMATIONAL SEARCH OF TETRA-O-METHYL-(-CATECHIN()), Tetrahedron letters, 35(14), 1994, pp. 2137-2140
Citations number
18
Categorie Soggetti
Chemistry Inorganic & Nuclear
Journal title
Tetrahedron letters → ACNP
ISSN journal
00404039
Volume
35
Issue
14
Year of publication
1994
Pages
2137 - 2140
Database
ISI
SICI code
0040-4039(1994)35:14<2137:PHRCTA>2.0.ZU;2-S
Abstract
A GMMX(c) conformational search routine gives a family of conformation s that reflects the Boltzmann-averaged heterocyclic ring conformation as evidenced by accurate prediction of all three coupling constants ob served for tetra-O-methyl-(+)-catechin.