Cargando…
Anharmonic Vibrational Raman Optical Activity of Methyloxirane: Theory and Experiment Pushed to the Limits
[Image: see text] Combining Raman scattering and Raman optical activity (ROA) with computer simulations reveals fine structural and physicochemical properties of chiral molecules. Traditionally, the region of interest comprised fundamental transitions within 200–1800 cm(–1). Only recently, nonfundam...
Autores principales: | Yang, Qin, Kapitán, Josef, Bouř, Petr, Bloino, Julien |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
|
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9531246/ https://www.ncbi.nlm.nih.gov/pubmed/36125432 http://dx.doi.org/10.1021/acs.jpclett.2c02320 |
Ejemplares similares
-
Anharmonic Aspects
in Vibrational Circular Dichroism
Spectra from 900 to 9000 cm(–1) for Methyloxirane
and Methylthiirane
por: Fusè, Marco, et al.
Publicado: (2022) -
Analytic calculations of anharmonic infrared and Raman vibrational spectra
por: Cornaton, Yann, et al.
Publicado: (2016) -
Two Spectroscopies in One: Interference of Circular Dichroism and Raman Optical Activity
por: Wu, Tao, et al.
Publicado: (2020) -
Recognition of the True and False Resonance Raman Optical Activity
por: Machalska, Ewa, et al.
Publicado: (2021) -
An Effective and
Automated Processing of Resonances
in Vibrational Perturbation Theory Applied to Spectroscopy
por: Yang, Qin, et al.
Publicado: (2022)