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A CLFSE/MM study on the role of ligand bite-angle in Cu(II)-catalyzed Diels-Alder reactions

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UNSPECIFIED (1999) A CLFSE/MM study on the role of ligand bite-angle in Cu(II)-catalyzed Diels-Alder reactions. TETRAHEDRON LETTERS, 40 (7). pp. 1233-1236. ISSN 0040-4039

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Abstract

A single force-field has been developed for modeling bis(oxazoline) and pyridine-bis(oxazoline) copper(II)-complexes. Using this force field the role of ligand bite-angle on the enantioselectivity of Cu(II)-catalyzed Diels-Alder was confirmed and for the first time, a direct comparison of the role of C-4 oxazoline substituents was achieved. (C) 1999 Elsevier Science Ltd. All rights reserved.

Item Type: Journal Article
Subjects: Q Science > QD Chemistry
Journal or Publication Title: TETRAHEDRON LETTERS
Publisher: PERGAMON-ELSEVIER SCIENCE LTD
ISSN: 0040-4039
Date: 12 February 1999
Volume: 40
Number: 7
Number of Pages: 4
Page Range: pp. 1233-1236
Publication Status: Published
URI: http://wrap.warwick.ac.uk/id/eprint/14912

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