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  • About
  • The Global ETD Search service is a free service for researchers to find electronic theses and dissertations. This service is provided by the Networked Digital Library of Theses and Dissertations.
    Our metadata is collected from universities around the world. If you manage a university/consortium/country archive and want to be added, details can be found on the NDLTD website.

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1

Tuning proton behavior in a ternary molecular complex.

Thomas, L.H., Blagden, Nicholas, Gutmann, M.J., Kallay, A.A., Parkin, A., Seaton, Colin C., Wilson, C.C. 06 1900 (has links)
No / The multicomponent ternary complex of 4-dimethylaminobenzoic acid (4-DABA), 3,5-dinitrobenzoic acid (3,5-DNBA), and 4,40-bipyridine (BIPY) has been studied by variable temperature X-ray and neutron diffraction. Proton disorder is observed within the 4-DABA homodimers present and quantitatively evaluated from neutron data. The effect of the crystal environment and in particular the pyramidalization of the nitrogen atom within the 4-DABA molecule and the consequential effect on the presence of hydrogen atom disorder are discussed with reference to the previously determined pure 4-DABA structure and the binary cocrystal with 3,5-DNBA.
Ternary molecular complex
Crystal engineering
Proton behaviour
4-dimethylaminobenzoic acid (4-DABA)
3
5-dinitrobenzoic acid (3
5-DNBA)
4
40-bipyridine (BIPY)

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