Journal of Photochemistry and Photobiology A: Chemistry, volume 277, pages 37-44
Photochemical transformations of 5-methyltetrazole. Matrix isolation FTIR and DFT studies
Publication type: Journal Article
Publication date: 2014-03-01
Quartile SCImago
Q2
Quartile WOS
Q2
Impact factor: 4.3
ISSN: 10106030, 18732666
General Chemistry
General Chemical Engineering
General Physics and Astronomy
Abstract
In situ photolysis of 5-methyltetrazole (MT) isolated in low temperature argon matrices was induced by tunable UV laser radiation. The progress of the reactions was followed by FTIR spectroscopy that allowed for spectroscopic identification of three photoproducts resulting from the MT ring cleavage, namely C-methylnitrilimine CH3CNNH, N-methylcarbodiimide CH3NCNH, methylcyanamide CH3NHCN. The kinetic profiles obtained for these products show different behavior of the species in the course of irradiation. The N-methylcarbodiimide molecules were found to decompose further into two HCN or HNC molecules that interact in the matrix cages to form different hydrogen bonded dimers. Interpretation of the observed photoprocesses was supported by quantum chemical calculations (DFT, TD-DFT).
Top-30
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Citations by publishers
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Elsevier
7 publications, 50%
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American Chemical Society (ACS)
3 publications, 21.43%
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2 publications, 14.29%
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1 publication, 7.14%
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1 publication, 7.14%
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- We do not take into account publications without a DOI.
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Pagacz Kostrzewa M., Krupa J., WIERZEJEWSKA M. Photochemical transformations of 5-methyltetrazole. Matrix isolation FTIR and DFT studies // Journal of Photochemistry and Photobiology A: Chemistry. 2014. Vol. 277. pp. 37-44.
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Pagacz Kostrzewa M., Krupa J., WIERZEJEWSKA M. Photochemical transformations of 5-methyltetrazole. Matrix isolation FTIR and DFT studies // Journal of Photochemistry and Photobiology A: Chemistry. 2014. Vol. 277. pp. 37-44.
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TY - JOUR
DO - 10.1016/j.jphotochem.2013.12.011
UR - https://doi.org/10.1016/j.jphotochem.2013.12.011
TI - Photochemical transformations of 5-methyltetrazole. Matrix isolation FTIR and DFT studies
T2 - Journal of Photochemistry and Photobiology A: Chemistry
AU - Pagacz Kostrzewa, Magdalena
AU - Krupa, Justyna
AU - WIERZEJEWSKA, M
PY - 2014
DA - 2014/03/01 00:00:00
PB - Elsevier
SP - 37-44
VL - 277
SN - 1010-6030
SN - 1873-2666
ER -
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@article{2014_Pagacz Kostrzewa,
author = {Magdalena Pagacz Kostrzewa and Justyna Krupa and M WIERZEJEWSKA},
title = {Photochemical transformations of 5-methyltetrazole. Matrix isolation FTIR and DFT studies},
journal = {Journal of Photochemistry and Photobiology A: Chemistry},
year = {2014},
volume = {277},
publisher = {Elsevier},
month = {mar},
url = {https://doi.org/10.1016/j.jphotochem.2013.12.011},
pages = {37--44},
doi = {10.1016/j.jphotochem.2013.12.011}
}