The molecular and crystal structure of 4,7-[2.2]paracyclophane quinone and its thermal motion have been studied using single-crystal X-ray diffraction data. Topological analysis of the electron density distribution [MP2(FC)/6-31G(d,p) calculation] revealed the absence of intramolecular transannular interactions between two aromatic rings.
Transannular interaction in 4,7-[2.2]paracyclophane quinone
I. V. Fedyanin, K. A. Lyssenko, N. V. Vorontsova, V. I. Rozenberg and M. Yu. Antipin, Mendeleev Commun., 2003, 13, 15 DOI: 10.1070/MC2003v013n01ABEH001693
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