S
S. A. Katsyuba
Researcher at Russian Academy of Sciences
Publications - 23
Citations - 136
S. A. Katsyuba is an academic researcher from Russian Academy of Sciences. The author has contributed to research in topics: Molecule & Density functional theory. The author has an hindex of 6, co-authored 20 publications receiving 110 citations.
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Journal ArticleDOI
Vibrational spectra and conformational isomerism of calixarene building blocks. Part I. Diphenylmethane, (C 6 H 5 ) 2 CH 2
TL;DR: In this paper, a conformational and normal coordinate analysis of vibrational spectra of diphenylmethane molecule has been realized within the framework of density functional theory, and the calculated force field (B3LYP/6-31G∗) was transformed to nonredundant internal coordinates.
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In situ electrochemical synthesis of Ni(I) complexes with aminomethylphosphines as intermediates for hydrogen evolution
Vera V. Khrizanforova,Vladimir I. Morozov,Anna G. Strelnik,Yu. S. Spiridonova,Mikhail Khrizanforov,Timur I. Burganov,S. A. Katsyuba,Sh. K. Latypov,M. K. Kadirov,A. A. Karasik,Oleg G. Sinyashin,Yulia H. Budnikova +11 more
TL;DR: In this article, Ni(I) complexes of 1,5-diaza-3,7-diphosphacyclooctane PPh2NR2 ligands were obtained from precursors at the Ni(II/I) couple potential and characterized by several techniques.
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Halochromic luminescent quinoxalinones as a basis for pH-sensing in organic and aqueous solutions
T. P. Gerasimova,Timur I. Burganov,S. A. Katsyuba,Alexey A. Kalinin,Liliya N. Islamova,G. M. Fazleeva,B.S. Ahmadeev,A. R. Mustafina,Antonio Monari,Xavier Assfeld,Oleg G. Sinyashin +10 more
TL;DR: In this paper, a series of quoxalin-2-ones dyes with N,N-dialkylaminostyryl substituent in different positions of the quinoxalinone (Qon) moiety has been experimentally and computationally studied.
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Vibrational spectra and conformational isomerism of calixarene building blocks: 2-benzylphenol
TL;DR: In this paper, the conformations and vibrational spectra of 2-benzylphenol have been analyzed within the framework of scaled quantum mechanics, and it has been shown that the solid-state conformation of the 2-Benzyl phenol molecule corresponds to one of four potential energy minima predicted by non-empirical quantum chemical calculations for the isolated molecule.
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Synthesis and structure of the iron( iii ) tris-chelate complex based on 1,1´-ferrocenediylbis(phenylphosphinic acid)
R. P. Shekurov,Daut R. Islamov,Dmitry B. Krivolapov,Vasily A. Miluykov,Olga N. Kataeva,T. P. Gerasimova,S. A. Katsyuba,Oleg G. Sinyashin +7 more
TL;DR: The previously unknown isomorphous tris{µ2-[1,1´-ferrocenediylbis(phenylphosphinato)]}-iron(iii) complexes as solvates with methanol and DMSO were synthesized and characterized as mentioned in this paper.