On the Connection of High-Resolution NMR Spectrum Mirror Symmetry With Spin System Properties

Fuente: arXiv
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Auteurs principaux: Cheshkov, Dmitry A., Sinitsyn, Dmitry O.
Format: Preprint
Publié: 2025
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author Cheshkov, Dmitry A.
Sinitsyn, Dmitry O.
author_facet Cheshkov, Dmitry A.
Sinitsyn, Dmitry O.
contents A correlation between the symmetry of NMR spectra, including higher-order spectra, and the properties of the spin system has been established. It is shown that for a spectrum to be symmetric about the mid-resonance frequency (ν0), two conditions must be satisfied: the resonant frequencies of the spins must be symmetrically positioned about ν0, and the J coupling matrix must be symmetric about the secondary diagonal. The results were validated by calculating theoretical spectra for 4-, 5-, and 6-spin systems.
format Preprint
id arxiv_https___arxiv_org_abs_2510_25551
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle On the Connection of High-Resolution NMR Spectrum Mirror Symmetry With Spin System Properties
Cheshkov, Dmitry A.
Sinitsyn, Dmitry O.
Chemical Physics
A correlation between the symmetry of NMR spectra, including higher-order spectra, and the properties of the spin system has been established. It is shown that for a spectrum to be symmetric about the mid-resonance frequency (ν0), two conditions must be satisfied: the resonant frequencies of the spins must be symmetrically positioned about ν0, and the J coupling matrix must be symmetric about the secondary diagonal. The results were validated by calculating theoretical spectra for 4-, 5-, and 6-spin systems.
title On the Connection of High-Resolution NMR Spectrum Mirror Symmetry With Spin System Properties
topic Chemical Physics
url https://arxiv.org/abs/2510.25551