Improving the IR spectra alignment algorithm with spectra deconvolution and combination with Raman or VCD spectroscopy - Physical Chemistry Chemical Physics (RSC Publishing)

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 alignment (IRSA) algorithm for automated optimal alignment. IRSA provide

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Improving the IR spectra alignment algorithm with spectra deconvolution and combination with Raman or VCD spectroscopy - Physical Chemistry Chemical Physics (RSC Publishing) DOI:10.1039/D2CP04907D

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Improving the IR spectra alignment algorithm with spectra

Improving the IR spectra alignment algorithm with spectra deconvolution and combination with Raman or VCD spectroscopy - Physical Chemistry Chemical Physics (RSC Publishing) DOI:10.1039/D2CP04907D

Improving the IR spectra alignment algorithm with spectra deconvolution and combination with Raman or VCD spectroscopy - Physical Chemistry Chemical Physics (RSC Publishing) DOI:10.1039/D2CP04907D