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Title: A charge density study of an intramolecular charge-transfer quinoid compound with strong NLO properties
Authors: Gopalan, R Srinivasa
Kulkarni, G U
Ravi, M
Rao, C N R
Keywords: X-Ray
Issue Date: Sep-2001
Publisher: Royal Society Chemistry
Citation: New Journal Of Chemistry 25(9), 1108-1110 (2001)
Abstract: 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.
Other Identifiers: 1144-0546
Appears in Collections:Research Papers (Prof. C.N.R. Rao)

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