Single-Crystal Infrared and Raman Spectra of Cyanuric Chloride

Abstract
The single‐crystal infrared and Raman spectra of cyanuric chloride, 1,3,5‐trichlorotriazine, were measured at 298 and 77°K. A complete assignment for the intramolecular fundamentals was made, including a study of a modified valence force field. Intensity predictions from the oriented gas model qualitatively agreed with the experimental results for the intensity of the free molecule Raman‐active bands. Spectral measurements in the low‐frequency region resulted in the assignment of several bands to the optically active lattice modes of cyanuric chloride.

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