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Electronic Effects Steer the Mechanism of Asymmetric Hydrogenations of Unfunctionalized Aryl-Substituted Alkenes

โœ Scribed by Fan, Yubo; Cui, Xiuhua; Burgess, Kevin; Hall, Michael B.


Book ID
126301693
Publisher
American Chemical Society
Year
2004
Tongue
English
Weight
499 KB
Volume
126
Category
Article
ISSN
0002-7863

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โœ Leland C. Allen; Robert N. Belkin ๐Ÿ“‚ Article ๐Ÿ“… 1977 ๐Ÿ› Elsevier Science โš– 389 KB

Dimerization energies, ED, internuclear separations, R, and directionality angles have been obtained for the electron donor substituted hydrogen bonds, HO-H\*\*+OHX, X=H, CH3, NH2, OH, and F, from ab initio -molecular orbital calculations with the 4-31G basis. The internuclear separations and direct