Jusélius Jonas, Sundholm Dage
Department of Chemistry, University of Tromsø, Tromsø, N-9037, Norway.
Phys Chem Chem Phys. 2008 Nov 28;10(44):6630-4. doi: 10.1039/b808082h. Epub 2008 Sep 25.
Magnetically induced current densities have been calculated for a series of hydrocarbons consisting of hexadehydro[12]annulene rings alternatingly fused with benzenes. The calculations show that all molecular rings of the studied molecules sustain paramagnetic ring currents. The new class of molecules is therefore coined polycyclic antiaromatic hydrocarbons (PAAH).
已计算出一系列由与苯交替稠合的十六脱氢[12]轮烯环组成的碳氢化合物的磁感应电流密度。计算结果表明,所研究分子的所有分子环都存在顺磁环电流。因此,这类新分子被命名为多环反芳香烃(PAAH)。