Indirect relativistic bridge and substituent effects from the ‘heavy’ environment on the one-bond and two-bond13C1H spin-spin coupling constants
Тип публикации: Journal Article
Дата публикации: 2015-09-09
scimago Q3
wos Q3
БС2
SJR: 0.36
CiteScore: 4.1
Impact factor: 1.4
ISSN: 07491581, 1097458X
PubMed ID:
26352434
General Chemistry
General Materials Science
Краткое описание
Indirect relativistic bridge effect (IRBE) and indirect relativistic substituent effect (IRSE) induced by the 'heavy' environment of the IV-th, V-th and VI-th main group elements on the one-bond and geminal (13)C-(1)H spin-spin coupling constants are observed, and spin-orbit parts of these two effects were interpreted in terms of the third-order Rayleigh-Schrödinger perturbation theory. Both effects, IRBE and IRSE, rapidly increase with the total atomic charge of the substituents at the coupled carbon. The accumulation of IRSE for geminal coupling constants is not linear with respect to the number of substituents in contrast to the one-bond couplings where IRSE is an essentially additive quantity.
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Rusakova I. L., Rusakov Y., Krivdin L. Indirect relativistic bridge and substituent effects from the ‘heavy’ environment on the one-bond and two-bond13C1H spin-spin coupling constants // Magnetic Resonance in Chemistry. 2015. Vol. 54. No. 1. pp. 39-45.
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Rusakova I. L., Rusakov Y., Krivdin L. Indirect relativistic bridge and substituent effects from the ‘heavy’ environment on the one-bond and two-bond13C1H spin-spin coupling constants // Magnetic Resonance in Chemistry. 2015. Vol. 54. No. 1. pp. 39-45.
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TY - JOUR
DO - 10.1002/mrc.4313
UR - https://doi.org/10.1002/mrc.4313
TI - Indirect relativistic bridge and substituent effects from the ‘heavy’ environment on the one-bond and two-bond13C1H spin-spin coupling constants
T2 - Magnetic Resonance in Chemistry
AU - Rusakova, Irina L
AU - Rusakov, Yu.
AU - Krivdin, LB
PY - 2015
DA - 2015/09/09
PB - Wiley
SP - 39-45
IS - 1
VL - 54
PMID - 26352434
SN - 0749-1581
SN - 1097-458X
ER -
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@article{2015_Rusakova,
author = {Irina L Rusakova and Yu. Rusakov and LB Krivdin},
title = {Indirect relativistic bridge and substituent effects from the ‘heavy’ environment on the one-bond and two-bond13C1H spin-spin coupling constants},
journal = {Magnetic Resonance in Chemistry},
year = {2015},
volume = {54},
publisher = {Wiley},
month = {sep},
url = {https://doi.org/10.1002/mrc.4313},
number = {1},
pages = {39--45},
doi = {10.1002/mrc.4313}
}
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Rusakova, Irina L., et al. “Indirect relativistic bridge and substituent effects from the ‘heavy’ environment on the one-bond and two-bond13C1H spin-spin coupling constants.” Magnetic Resonance in Chemistry, vol. 54, no. 1, Sep. 2015, pp. 39-45. https://doi.org/10.1002/mrc.4313.