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Aliphatic C-H/π and Heteroatom/π Interactions in N -Aryl-3,4-(9′,10′-dihydroanthracene-9′,10′-diyl)succinimides

✍ Scribed by Raimondi, Laura; Benaglia, Maurizio; Cozzi, Franco

Book ID
125967289
Publisher
John Wiley and Sons
Year
2014
Tongue
English
Weight
200 KB
Volume
2014
Category
Article
ISSN
1434-193X

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## Abstract The calculated difference in the standard heat of formation Δ Δ~f~H°(298.15) of __n__‐ and __i__‐C~4~__H__~3~^•^ free radicals is 37.9 kJ mol^−1^ for G3MP2B3 and 45.0 kJ mol^−1^ for CCSD(T)‐CBS (W1U) calculations, which seems to preclude the direct even‐carbon radical pathway to benzene