Campus Units

Chemistry, Ames Laboratory

Document Type

Article

Publication Version

Published Version

Publication Date

1-1997

Journal or Book Title

Organometallics

Volume

16

Issue

2

First Page

158

Last Page

162

DOI

10.1021/om960567h

Abstract

Ab initio geometry optimizations for a series of azatitanatranes, ZTi[−NR(CH2)2−]3N, (Z = CH3, NH2, OH, F, and N(CH3)2; R = H and CH3), have been performed. An analysis of the transannular Ti−N interaction indicates that it is significantly stronger than that found in the analogous azasilatranes. Of special significance in this calculation is the fact that theory correctly predicts that the axial Ti−N bond is shorter than the equatorial Ti−N bonds.

Comments

Reprinted (adapted) with permission from Organometallics 16 (1997): 158, doi:10.1021/om960567h. Copyright 1997 American Chemical Society.

Copyright Owner

American Chemical Society

Language

en

File Format

application/pdf

Included in

Chemistry Commons

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