Improving the IR spectra alignment algorithm with spectra deconvolution and combination with Raman or VCD spectroscopy
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DOI: 10.1039/d2cp04907d
Abstract: The relative stereochemistry of organic molecules can be determined by comparing theoretical and experimental infrared (IR) spectra of all isomers and assessing the best match. For this purpose, we have recently developed the IR spectra… read more here.
Keywords: spectra alignment; spectroscopy; alignment algorithm; raman ... See more keywords