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volume 12 issue 11 pages 1-26

Symmetry/asymmetry of the NHN hydrogen bond in protonated 1,8-bis(Dimethylamino)naphthalene

Publication typeJournal Article
Publication date2020-11-23
scimago Q2
wos Q2
SJR0.467
CiteScore5.3
Impact factor2.2
ISSN20738994
Chemistry (miscellaneous)
Physics and Astronomy (miscellaneous)
General Mathematics
Computer Science (miscellaneous)
Abstract
Experimental and theoretical results are presented based on vibrational spectra and motional dynamics of 1,8-bis(dimethylamino)naphthalene (DMAN) and its protonated forms (DMANH+ and the DMANH+ HSO4− complex). The studies of these compounds have been performed in the gas phase and solid-state. Spectroscopic investigations were carried out by infrared spectroscopy (IR), Raman, and incoherent inelastic neutron scattering (IINS) experimental methods. Density functional theory (DFT) and Car–Parrinello molecular dynamics (CPMD) methods were applied to support our experimental findings. The fundamental investigations of hydrogen bridge vibrations were accomplished on the basis of isotopic substitutions (NH → ND). Special attention was paid to the bridged proton dynamics in the DMANH+ complex, which was found to be affected by interactions with the HSO4− anion.
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Piękoś P. et al. Symmetry/asymmetry of the NHN hydrogen bond in protonated 1,8-bis(Dimethylamino)naphthalene // Symmetry. 2020. Vol. 12. No. 11. pp. 1-26.
GOST all authors (up to 50) Copy
Piękoś P., Jezierska A., Panek J. J., Goremychkin E. A., Pozharskii A. F., Antonov A. S., Tolstoy P. M., Filarowski A. Symmetry/asymmetry of the NHN hydrogen bond in protonated 1,8-bis(Dimethylamino)naphthalene // Symmetry. 2020. Vol. 12. No. 11. pp. 1-26.
RIS |
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RIS Copy
TY - JOUR
DO - 10.3390/sym12111924
UR - https://doi.org/10.3390/sym12111924
TI - Symmetry/asymmetry of the NHN hydrogen bond in protonated 1,8-bis(Dimethylamino)naphthalene
T2 - Symmetry
AU - Piękoś, Patrycja
AU - Jezierska, Aneta
AU - Panek, Jarosław J.
AU - Goremychkin, Eugene A
AU - Pozharskii, Alexander F
AU - Antonov, Alexander S.
AU - Tolstoy, Peter M.
AU - Filarowski, Alexander
PY - 2020
DA - 2020/11/23
PB - MDPI
SP - 1-26
IS - 11
VL - 12
SN - 2073-8994
ER -
BibTex |
Cite this
BibTex (up to 50 authors) Copy
@article{2020_Piękoś,
author = {Patrycja Piękoś and Aneta Jezierska and Jarosław J. Panek and Eugene A Goremychkin and Alexander F Pozharskii and Alexander S. Antonov and Peter M. Tolstoy and Alexander Filarowski},
title = {Symmetry/asymmetry of the NHN hydrogen bond in protonated 1,8-bis(Dimethylamino)naphthalene},
journal = {Symmetry},
year = {2020},
volume = {12},
publisher = {MDPI},
month = {nov},
url = {https://doi.org/10.3390/sym12111924},
number = {11},
pages = {1--26},
doi = {10.3390/sym12111924}
}
MLA
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MLA Copy
Piękoś, Patrycja, et al. “Symmetry/asymmetry of the NHN hydrogen bond in protonated 1,8-bis(Dimethylamino)naphthalene.” Symmetry, vol. 12, no. 11, Nov. 2020, pp. 1-26. https://doi.org/10.3390/sym12111924.