Magnetic Resonance in Chemistry, volume 60, issue 8, pages 733-828
Computational 1 H and 13 C NMR in structural and stereochemical studies
Publication type: Journal Article
Publication date: 2022-05-31
Journal:
Magnetic Resonance in Chemistry
Quartile SCImago
Q2
Quartile WOS
Q3
Impact factor: 2
ISSN: 07491581, 1097458X
DOI:
10.1002/mrc.5260
General Chemistry
General Materials Science
Abstract
Present review outlines the advances and perspectives of computational 1 H and 13 C NMR applied to the stereochemical studies of inorganic, organic, and bioorganic compounds, involving in particular natural products, carbohydrates, and carbonium ions. The first part of the review briefly outlines theoretical background of the modern computational methods applied to the calculation of chemical shifts and spin-spin coupling constants at the DFT and the non-empirical levels. The second part of the review deals with the achievements of the computational 1 H and 13 C NMR in the stereochemical investigation of a variety of inorganic, organic, and bioorganic compounds, providing in an abridged form the material partly discussed by the author in a series of parent reviews. Major attention is focused herewith on the publications of the recent years, which were not reviewed elsewhere.
Top-30
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Magnetic Resonance in Chemistry
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1 publication, 5%
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Citations by publishers
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Wiley
9 publications, 45%
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Royal Society of Chemistry (RSC)
3 publications, 15%
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American Chemical Society (ACS)
3 publications, 15%
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Elsevier
2 publications, 10%
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Springer Nature
1 publication, 5%
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Multidisciplinary Digital Publishing Institute (MDPI)
1 publication, 5%
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Autonomous Non-profit Organization Editorial Board of the journal Uspekhi Khimii
1 publication, 5%
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- We do not take into account publications without a DOI.
- Statistics recalculated only for publications connected to researchers, organizations and labs registered on the platform.
- Statistics recalculated weekly.
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Krivdin L. B. Computational 1 H and 13 C NMR in structural and stereochemical studies // Magnetic Resonance in Chemistry. 2022. Vol. 60. No. 8. pp. 733-828.
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Krivdin L. B. Computational 1 H and 13 C NMR in structural and stereochemical studies // Magnetic Resonance in Chemistry. 2022. Vol. 60. No. 8. pp. 733-828.
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TY - JOUR
DO - 10.1002/mrc.5260
UR - https://doi.org/10.1002/mrc.5260
TI - Computational 1 H and 13 C NMR in structural and stereochemical studies
T2 - Magnetic Resonance in Chemistry
AU - Krivdin, Leonid B.
PY - 2022
DA - 2022/05/31 00:00:00
PB - Wiley
SP - 733-828
IS - 8
VL - 60
SN - 0749-1581
SN - 1097-458X
ER -
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@article{2022_Krivdin,
author = {Leonid B. Krivdin},
title = {Computational 1 H and 13 C NMR in structural and stereochemical studies},
journal = {Magnetic Resonance in Chemistry},
year = {2022},
volume = {60},
publisher = {Wiley},
month = {may},
url = {https://doi.org/10.1002/mrc.5260},
number = {8},
pages = {733--828},
doi = {10.1002/mrc.5260}
}
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Krivdin, Leonid B.. “Computational 1 H and 13 C NMR in structural and stereochemical studies.” Magnetic Resonance in Chemistry, vol. 60, no. 8, May. 2022, pp. 733-828. https://doi.org/10.1002/mrc.5260.