Study of the Reactions of Fullerene С60 with the Palladium-Containing Clusters of Molybdenum {Mo3PdS4} by Spectroscopic and Calculation Methods

Yu A. Laricheva; N. Yu Shmelev; A. L. Gushchin; M. N. Sokolov

doi:10.1134/S1070328421020032

Study of the Reactions of Fullerene С₆₀ with the Palladium-Containing Clusters of Molybdenum {Mo₃PdS₄} by Spectroscopic and Calculation Methods

Yu A. Laricheva, N. Yu Shmelev, A. L. Gushchin, M. N. Sokolov

Результат исследования: Научные публикации в периодических изданиях › статья › рецензирование

Аннотация

The fabrication of hybrid materials combining the physicochemical properties of various classes is a complicated but promising trend for the development of the modern science. The formation of new hybrid cluster cations [Mo₃Pd(C₆₀)S₄Cl₃(R₂Bipy)₃]⁺ and [{Mo₃PdS₄Cl₃(R₂Bipy)₃}₂(C₆₀)]²⁺ (Bipy is 2,2-bipyridine) containing fullerene C₆₀ coordinated to the palladium atom by the reaction of [Mo₃S₄Cl₃(R₂Bipy)₃]PF₆ with Pd₂(Dba)₃ (Dba is dibenzylideneacetone) and C₆₀ is shown by a complex of physicochemical methods. The reaction products are studied by IR and NMR (¹H, ³¹Р, and C–H correlations) spectroscopy and mass spectrometry. The quantum-chemical calculations are performed by the DFT method for the correct interpretation of the spectroscopic data and elucidation of the electronic structures of the fullerene-containing compounds.

Язык оригинала	английский
Страницы (с-по)	196-203
Число страниц	8
Журнал	Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya
Том	47
Номер выпуска	3
DOI	https://doi.org/10.1134/S1070328421020032
Состояние	Опубликовано - мар 2021

Предметные области OECD FOS+WOS

2.04 ХИМИЧЕСКИЕ ТЕХНОЛОГИИ
1.04 ХИМИЧЕСКИЕ НАУКИ
1.04.EC ХИМИЯ, НЕОРГАНИЧЕСКАЯ И ЯДЕРНАЯ

Доступ к документу

10.1134/S1070328421020032

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@article{13271b3aa39944ccaed26b6e97f28381,

title = "Study of the Reactions of Fullerene С60 with the Palladium-Containing Clusters of Molybdenum {Mo3PdS4} by Spectroscopic and Calculation Methods",

abstract = "The fabrication of hybrid materials combining the physicochemical properties of various classes is a complicated but promising trend for the development of the modern science. The formation of new hybrid cluster cations [Mo3Pd(C60)S4Cl3(R2Bipy)3]+ and [{Mo3PdS4Cl3(R2Bipy)3}2(C60)]2+ (Bipy is 2,2-bipyridine) containing fullerene C60 coordinated to the palladium atom by the reaction of [Mo3S4Cl3(R2Bipy)3]PF6 with Pd2(Dba)3 (Dba is dibenzylideneacetone) and C60 is shown by a complex of physicochemical methods. The reaction products are studied by IR and NMR (1H, 31Р, and C–H correlations) spectroscopy and mass spectrometry. The quantum-chemical calculations are performed by the DFT method for the correct interpretation of the spectroscopic data and elucidation of the electronic structures of the fullerene-containing compounds.",

keywords = "cluster complexes, DFT calculations, fullerene, molybdenum, palladium",

author = "Laricheva, {Yu A.} and Shmelev, {N. Yu} and Gushchin, {A. L.} and Sokolov, {M. N.}",

note = "Funding Information: This work was supported by the Russian Foundation for Basic Research, projects nos. 18-33-20056 and 19-33-90097. Publisher Copyright: {\textcopyright} 2021, Pleiades Publishing, Ltd. Copyright: Copyright 2021 Elsevier B.V., All rights reserved.",

year = "2021",

month = mar,

doi = "10.1134/S1070328421020032",

language = "English",

volume = "47",

pages = "196--203",

journal = "Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya",

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Study of the Reactions of Fullerene С₆₀ with the Palladium-Containing Clusters of Molybdenum {Mo₃PdS₄} by Spectroscopic and Calculation Methods. / Laricheva, Yu A.; Shmelev, N. Yu; Gushchin, A. L.; Sokolov, M. N.

В: Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya, Том 47, № 3, 03.2021, стр. 196-203.

Результат исследования: Научные публикации в периодических изданиях › статья › рецензирование

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T1 - Study of the Reactions of Fullerene С60 with the Palladium-Containing Clusters of Molybdenum {Mo3PdS4} by Spectroscopic and Calculation Methods

AU - Laricheva, Yu A.

AU - Shmelev, N. Yu

AU - Gushchin, A. L.

AU - Sokolov, M. N.

N1 - Funding Information: This work was supported by the Russian Foundation for Basic Research, projects nos. 18-33-20056 and 19-33-90097. Publisher Copyright: © 2021, Pleiades Publishing, Ltd. Copyright: Copyright 2021 Elsevier B.V., All rights reserved.

PY - 2021/3

Y1 - 2021/3

N2 - The fabrication of hybrid materials combining the physicochemical properties of various classes is a complicated but promising trend for the development of the modern science. The formation of new hybrid cluster cations [Mo3Pd(C60)S4Cl3(R2Bipy)3]+ and [{Mo3PdS4Cl3(R2Bipy)3}2(C60)]2+ (Bipy is 2,2-bipyridine) containing fullerene C60 coordinated to the palladium atom by the reaction of [Mo3S4Cl3(R2Bipy)3]PF6 with Pd2(Dba)3 (Dba is dibenzylideneacetone) and C60 is shown by a complex of physicochemical methods. The reaction products are studied by IR and NMR (1H, 31Р, and C–H correlations) spectroscopy and mass spectrometry. The quantum-chemical calculations are performed by the DFT method for the correct interpretation of the spectroscopic data and elucidation of the electronic structures of the fullerene-containing compounds.

AB - The fabrication of hybrid materials combining the physicochemical properties of various classes is a complicated but promising trend for the development of the modern science. The formation of new hybrid cluster cations [Mo3Pd(C60)S4Cl3(R2Bipy)3]+ and [{Mo3PdS4Cl3(R2Bipy)3}2(C60)]2+ (Bipy is 2,2-bipyridine) containing fullerene C60 coordinated to the palladium atom by the reaction of [Mo3S4Cl3(R2Bipy)3]PF6 with Pd2(Dba)3 (Dba is dibenzylideneacetone) and C60 is shown by a complex of physicochemical methods. The reaction products are studied by IR and NMR (1H, 31Р, and C–H correlations) spectroscopy and mass spectrometry. The quantum-chemical calculations are performed by the DFT method for the correct interpretation of the spectroscopic data and elucidation of the electronic structures of the fullerene-containing compounds.

KW - cluster complexes

KW - DFT calculations

KW - fullerene

KW - molybdenum

KW - palladium

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