Repozytorium

Hydrogen bonds in betaine-acid (1:1) crystals revealed by Raman and 13C chemical shift tensors.

Autorzy

Marek Ilczyszyn

Maria M. Ilczyszyn

Rok wydania

2017

Czasopismo

Journal of Molecular Structure

Numer woluminu

1137

Strony

292-299

DOI

10.1016/j.molstruc.2017.02.048

Kolekcja

Naukowa

Język

Angielski

Typ publikacji

Artykuł

Streszczenie

H-bonds of five betaine-acid (1:1) crystals are considered by analysis of tensors based on the Raman scissoring mode and 13C chemical shift of the betaine –CO1O2 carboxylate group. The leading structural factor in these systems is the strongest H-bond linking the betaine and the acidic moieties, (O1⋯H-O)com. The Raman and NMR tensors are strongly related to its character and to the R(O1⋯O)com distance. Very high molecular polarizability variation due to the scissoring vibration was found for the betaine-selenious acid crystal. The probable reason is modest network of H-bonds in this case and relatively high proton polarizability of these bonds

Słowa kluczowe

Betaine-acid crystals, hydrogen bonds, Raman tensor, NMR tensor, Proton polarizability

Adres publiczny

http://dx.doi.org/10.1016/j.molstruc.2017.02.048

Strona internetowa wydawcy

http://www.elsevier.com

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