Quantum-Chemical ab initio Calculations on the lowest Singlet and Triplet States of Heteroaromatics (C5H5X) with X = B, Al, Ga, In and Tl.

Stefanie Mersmann,A Halima Mouhib,A Emma Persoon,A Yuekui Wang,B Matthias Baldofski,A and Gerhard RaabeA

A Institut für Organische Chemie, RWTH Aachen University, Landoltweg 1, D-52074 Aachen, Germany B Key Laboratory of Chemical Biology and Molecular Engineering of the Education Ministry, Institute of Molecular Science, Shanxi University, Taiyuan, Shanxi 030006, P. R China