Single-crystal 2H NMR of deuterated 1,10-decanedicarboxylic acid included in hydrogenated urea channels |
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Authors: | Odin C Garcia P |
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Affiliation: | Groupe Matière Condensée et Matériaux, UMR 6626 au CNRS, Université Rennes I, Campus de Beaulieu, 35042 Rennes Cedex, France. christophe.odin@univ-rennes1.fr |
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Abstract: | The intergrowth of 1,10-decanedicarboxylic acid and urea give infinite hydrogen-bonded chains of the guest included in the hexagonal urea host. A deuterium high-resolution solid-state NMR study of the selectively deuterated intergrowth compound 1,10-decanedicarboxylic acid/hydrogenated urea at variable temperature in the range 90 < or = T < or = 300 K was performed on a single crystal. The analysis of the second moment as a function of temperature is shown to be compatible with the known phase transition occurring near T(c) = 203 K. Moreover, the spectra indicate that the orientational disorder is strong, and is compared to an axial uniform disorder. For this purpose, the general equation for the second moment of a system with uniform two-dimensional axial orientational disorder is given, and a method to take into account the non-uniform excitation of the pulse sequence is proposed. |
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Keywords: | NMR solid‐state NMR 2H NMR second moment analysis orientational disorder phase transition |
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