Электронная библиотека (репозиторий) Томского государственного университета
ароматичность | 2015

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Add   Aromatic pathways in carbathiaporphyrins
Authors: Valiev, Rashid R. | Fliegl, Heike | Sundholm, Dage
Source: The Journal of Physical Chemistry A. 2015. Vol. 119, № 7. P. 1201-1207
Type: статьи в журналах
Date: 2015
Description: Magnetically induced current densities and current pathways have been calculated for carbaporphyrins and carbathiaporphyrins using the gauge including magnetically induced current (GIMIC) method. The ... More
Add   Aromaticity of the completely annelated tetraphenylenes: NICS and GIMIC characterization
Authors: Baryshnikov, Gleb V. | Valiev, Rashid R. | Minaev, Boris F. | Karaush, Nataliya N.
Source: Journal of molecular modeling. 2015. Vol. 21, № 6. P. 136 (1-9)
Type: статьи в журналах
Date: 2015
Description: A series of heterocyclic and hydrocarbon [8]circulenes (also named completely annelated tetraphenylenes) were studied by the NICS and GIMIC methods in order to describe their aromatic properties from ... More
Add   Predicting the degree of aromaticity of novel carbaporphyrinoids
Authors: Valiev, Rashid R. | Fliegl, Heike | Sundholm, Dage
Source: Physical chemistry chemical physics. 2015. Vol. 17, № 21. P. 14215-14222
Type: статьи в журналах
Date: 2015
Description: Magnetically induced current densities have been calculated for dioxaporphyrin, dithiaporphyrin, true carbaporphyrins, and N-confused porphyrins using the gauge-including magnetically induced current ... More
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