An experimental charge density investigation of 7,7-di[(S)-(+)-2-(methoxymethyl)pyrrolidino]-8,8-dicyanoquinodimethane establishes the presence of a large charge separation as well as a high in-crystal dipole moment compared to the free molecule in frozen geometry, consistent with the high SHG activity of the compound.
R. Srinivasa Gopalan, G. U. Kulkarni, M. Ravi and C. N. R. Rao, New J. Chem., 2001, 25, 1108 DOI: 10.1039/B103117C
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