Several aspects of intermolecular interactions between the carbonyl and imine groups in the crystals of compounds containing six-membered heterocycles View Full Text


Ontology type: schema:ScholarlyArticle     


Article Info

DATE

2008-09

AUTHORS

N. I. Golovina, G. N. Nechiporenko, I. N. Zyuzin, D. B. Lempert, G. G. Nemtsev, G. V. Shilov, A. N. Utenyshev, K. V. Bozhenko

ABSTRACT

Three modifier compounds that stabilize the phase state of ammonium nitrate over a wide range of temperatures, 1,3,5-trihydroxyisocyanuric acid dihydrate (1), 4-aminouracil (2), and 4-aminouracil monohydrate (3) were studied by X-ray diffraction. Strong donor-acceptor intermolecular interactions were found for structures 2 and 3. The electronic parameters of the molecules were calculated by quantum-chemical methods, and it was found that additional intermolecular interactions were possible. More... »

PAGES

909-916

Identifiers

URI

http://scigraph.springernature.com/pub.10.1007/s10947-008-0156-7

DOI

http://dx.doi.org/10.1007/s10947-008-0156-7

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1035627473


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