
Article
π Bond Strengths in the Second and Third Periods
Journal of the American Chemical Society
(1987)
Abstract
All possible pi bonds formed between the elements C, N, 0, Si, P, and S are considered. The pi bond strengths are estimated by the cis-trans rotation barriers (where possible) and by hydrogenation energies. The ability of these elements to form strong pibonds is in the order 0 > N "" C » S > P > Si. In addition, computed bond lengths and vibrational stretching frequencies are reported for both the singly and doubly bound compounds. The structure of the lowest triplet state of each double-bonded compound is given, along with the singlet-triplet splitting.
Disciplines
Publication Date
August, 1987
Publisher Statement
Reprinted (adapted) with permission from Journal of the American Chemical Society 109 (1987): 5217, doi:10.1021/ja00251a029. Copyright 1987 American Chemical Society.
Citation Information
Michael W. Schmidt, Phi N. Truong and Mark S. Gordon. "π Bond Strengths in the Second and Third Periods" Journal of the American Chemical Society Vol. 109 Iss. 17 (1987) Available at: http://works.bepress.com/mark_gordon/61/