Solvent Effects on the Equilibrium between Localized and Delocalized States of Thermochromic Semibullvalenes and
1Institut für Organische Chemie der Universität, Am Hubland, D-97074 Würzburg, Germany, Fax: (+49) 931-888-4606. seefelde@chemie.uni-wuerzburg.de.
Angewandte Chemie (International Ed. in English)
|August 21, 2014
Abstract:
The position of the equilibrium between localized and delocalized states of thermochromic semibullvalenes and barbaralanes (see the Equation) depends strongly on the solvent. Dipolar aprotic solvents, particularly N,N'-dimethylpropylene urea, favor the delocalized, bishomoaromatic state (ΔH(0) =8 kJ mol(-1) (cyclohexane), ΔH(0) <0 kJ mol(-1) (N,N'-dimethylpropylene urea)).
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