Citation:
Han Xing LIU, Chia Chung SUN. THROUGH-SPACE AND THROUGH-BOND INTERACTIONS IN 1,5-CYCLOOCTADIYNE;THE ASSIGNMENT OF ITS PHOTOELECTRON SPECTRA[J]. Chinese Chemical Letters,
;1992, 3(6): 437-440.
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The through--space and through--bond interactions in 1, 5--Cyclooctadiyne arestudied.It is shown, with the assistance of improved MS--Xα method, that the through- spaceinteractions decrease with the distance of the orbitals, and both through--space and through--bondinteractions of 1, 5-Cyclooctadiyne are sizable but those two interactions oppose each othercausing the net splitting to be small for πz orbital.The calculated ionization potentials are in goodagreement with the experiment of photoelectron spectra
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