ISSN:
1432-2234
Keywords:
Ab initio
;
vdW complexes
;
Benzyne
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Summary Van der Waals complexes ofo-benzyne with carbon monoxide and with argon have been studiedab initio. In both cases “sandwich” structures were found to be more stable than planar structures. From the order of stability of the planar structures it was concluded that the classical description of the distorted triple bond ino-benzyne is not fully valid, and it is believed that one must also consider the biradical character of the triple bond ino-benzyne.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF01113616
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