Liquid 1H-1,2,3-Triazole Interpreted as a Continuous, Self-Assembled Hydrogen-Bonded Linear Network
Ashley E. Williams, Anna CraigHolan, Leah A. Surbaugh, Aron J. Huckaba et autres
The molecular-level organization of 1H -1,2,3-triazole in the liquid state is described as an extended hydrogen-bonded network, reminiscent of linear solution-phase polymer chains. Raman, IR, and no-D NMR spectroscopic data interpreted using density functional theory (DFT) computations reveal no evidence of the …
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The Journal of Physical Chemistry A