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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Antonova A.B., Chudin O.S., Rubaylo A.I., Pavlenko N.I., Sokolenko W.A., Verpekin V.V., Vasiliev A.D., Semeikin O.V.
Заглавие : Heteronuclear µ-vinylidene complexes containing Re, Cu, Fe, Pt, Pd. Synthesis, structure, IR and NMR spectra
Коллективы : Carbene Chemistry Conference The Ocean Maya
Место публикации : Carbene Chemistry Conference The Ocean Maya. - P.38
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Tomilin F. N., Artyushenko P. V., Shchugoreva I. A., Rogova A. V., Vnukova N. G., Churilov G. N., Shestakov N. P., Tchaikovskaya O. N., Ovchinnikov S. G., Avramov P. V.
Заглавие : Structure and vibrational spectroscopy of C82 fullerenol valent isomers: An experimental and theoretical joint study
Место публикации : Molecules. - 2023. - Vol. 28, Is. 4. - Ст.1569. - ISSN 14203049 (eISSN), DOI 10.3390/molecules28041569
Примечания : Cited References: 57. - Synthesis and spectroscopic study of the Gd@C82OxHy complexes were supported by the Ministry of Science and Higher Education of the Russian Federation under project FWES-2022-0005. Molecular design of the fullerene derivatives was supported by the National Research Foundation of the Republic of Korea, grant NRF 2021R1A2C1010455. DFTB3 electronic structure calculations were supported by Project FSWM-2020-0033 of the Russian Ministry of Science and Education
Аннотация: Gd@C82OxHy endohedral complexes for advanced biomedical applications (computer tomography, cancer treatment, etc.) were synthesized using high-frequency arc plasma discharge through a mixture of graphite and Gd2O3 oxide. The Gd@C82 endohedral complex was isolated by high-efficiency liquid chromatography and consequently oxidized with the formation of a family of Gd endohedral fullerenols with gross formula Gd@C82O8(OH)20. Fourier-transformed infrared (FTIR) spectroscopy was used to study the structure and spectroscopic properties of the complexes in combination with the DFTB3 electronic structure calculations and infrared spectra simulations. It was shown that the main IR spectral features are formed by a fullerenole C82 cage that allows one to consider the force constants at the DFTB3 level of theory without consideration of gadolinium endohedral ions inside the carbon cage. Based on the comparison of experimental FTIR and theoretical DFTB3 IR spectra, it was found that oxidation of the C82 cage causes the formation of Gd@C82O28H20, with a breakdown of the integrity of the parent C82 cage with the formation of pores between neighboring carbonyl and carboxyl groups. The Gd@C82O6(OOH)2(OH)18 endohedral complex with epoxy, carbonyl and carboxyl groups was considered the most reliable fullerenole structural model.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Verpekin V. V., Vasiliev A. D., Maksimov N. G., Burmakina G. V., Zimonin D. V., Nedelina T. S., Chudin O. S., Rubaylo A. I.
Заглавие : Structure, UV spectroscopic and electrochemical properties of 2-methyl-8-quinolinolato rhodium (I) complexes, containing carbonyl, triphenylphosphine or triphenylphosphite ligands
Место публикации : J. Mol. Struct. - 2022. - Vol. 1249. - Ст.131557. - ISSN 00222860 (ISSN), DOI 10.1016/j.molstruc.2021.131557
Примечания : Cited References: 31. - This work was conducted within the framework of the budget project # 121031500209-6 for Institute of Chemistry and Chemical Technology SB RAS using the equipment of Krasnoyarsk Regional Research Equipment center of Federal Research center, SB RAS. Authors are grateful to Alexander A. Kondrasenko for NMR measurements
Аннотация: The known Rh(2-Me-8-Oxq)(CO)2 complex (1) was prepared through treatment of dicarbonyl(acetylacetonate)rhodium (I) with 2-methyl-8-hydroxyquinoline for the first time. The reactions of 1 with triphenylphosphine and triphenylphosphite result in complexes Rh(2-Me-8-Oxq)(PPh3)(CO) (2) and Rh(2-Me-8-Oxq)[P(OPh)3](CO) (3) that were characterized by IR and NMR spectroscopy. The structures of complexes 2 and 3 were determined by single-crystal X-ray diffraction analysis. The complexes show the 2-methyl-8-quinolinolato ligand in the expected coordination mode with a slightly disordered square planar geometry at the rhodium center. In the crystal, molecules of Rh(2-Ме-8-Oxq)(CO)(PPh3) (2) form centrosymmetric dimers due to π-stacking interactions. No intermolecular contacts are observed in the crystal of 3. The UV spectroscopic and electrochemical properties of complexes 1–3 were studied. Their electronic spectra in CH3CN show three quinoline-centered absorptions. The electrochemical study revealed that the oxidation of the complexes 1–3 is two-electron and leads to the formation of dication Rh (III) species while their reduction gives radical anions, which undergoes rapid decomposition.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Verpekin V. V., Chudin O. S., Kondrasenko A. A., Burmakina G. V., Vasiliev A. D., Zimonin D. V., Rubaylo A. I.
Заглавие : Chemistry of vinylidene complexes—XXVII—new µ-vinylidene MnPt complexes with platinum-coordinated 1-adamantyl isocyanide ligand: spectroscopic, structural and electrochemical study
Место публикации : Transition Met. Chem. - 2022. - Vol. 47. Is. 7-8. - P.283-292. - ISSN 03404285 (ISSN), DOI 10.1007/s11243-022-00511-w
Примечания : Cited References: 46. - This work was conducted within the framework of the budget project 0287–2021-0012 for Institute of Chemistry and Chemical Technology SB RAS
Аннотация: New binuclear MnPt µ-vinylidene complexes Cp(CO)2Mn(µ-C=CHPh)Pt(CN–Ad)(L) [L=PPh3 (1a), P(OPri)3 (2a)] bearing a terminal platinum-coordinated 1-adamantyl isocyanide ligand were prepared by the treatment of Cp(CO)2Mn(µ-C=CHPh)Pt(CO)(L) [L=PPh3 (1b), P(OPri)3 (2b)] with CN-Ad. At the same time the reaction between Cp(CO)2Mn(µ-C=CHPh)Pt(L)2 [L=PPh3 (1c), P(OPri)3 (2c)] and CN-Ad did not proceed. The new complexes were characterized by IR and 1H, 13C, 31P NMR spectroscopy. The molecular structure of Cp(CO)2Mn(µ-C=CHPh)Pt(CN–Ad)[P(OPri)3] (2a) was determined by an X-ray diffraction study. The redox properties of the new complexes and their reactions of chemical oxidation were studied. An influence of the platinum-coordinated 1-adamantyl isocyanide ligand on the properties of the synthesized µ-vinylidene compounds 1a and 2a was revealed.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Verpekin, Victor V., Chudin, Oleg S., Vasiliev A. D., Kondrasenko, Alexander A., Shor, Aleksey M., Burmakina, G. V., Zimonin, D. V., Maksimov, N. G., Rubaylo, A. I.
Заглавие : Trinuclear ReFePt clusters with a μ3-phenylvinylidene ligand: synthetic approaches, rearrangement of vinylidene, and redox-induced transformations
Коллективы : [0287-2021-0012]
Место публикации : Dalton Trans. - 2022. - Vol. 51, Is. 1. - P.324-339. - ISSN 1477-9226, DOI 10.1039/d1dt03750a. - ISSN 1477-9234(eISSN)
Примечания : Cited References: 66. - This work was conducted within the framework of the budget project # 0287-2021-0012 for Institute of Chemistry and Chemical Technology SB RAS using the equipment of Krasnoyarsk Regional Research Equipment Centre of Federal Research Centre, SB RAS
Предметные рубрики: RAY CRYSTAL-STRUCTURE
METAL-METAL
HETEROBIMETALLIC COMPLEXES
Аннотация: A series of trinuclear μ3-vinylidene ReFePt clusters were synthesized by the application of two approaches: (i) reactions of the binuclear RePt μ-vinylidene complexes with Fe2(CO)9; (ii) ligand substitution or exchange reactions at the Pt atom in the synthesized ReFePt clusters. The molecular structures of CpReFePt(μ3-C==CHPh)(CO)5[P(OEt)3]L [L = CO; P(OEt)3] were determined by an X-ray diffraction study. The obtained compounds were studied by IR and 1H, 13C and 31P NMR spectroscopy. The spectroscopic study revealed that the clusters CpReFePt(μ3-C==CHPh)(CO)5[P(OEt)3]L [L = CO; P(OEt)3] and CpReFePt(μ3-C==CHPh)(CO)6[P(OPri)3] undergo isomerization upon dissolution, resulting in three isomers with different positions of the μ3-vinylidene ligand over the ReFePt core. The redox properties of the clusters were studied by electrochemical methods. The relatively stable cation-radicals obtained by chemical oxidation of CpReFePt(μ3-C==CHPh)(CO)6[P(OPri)3] and CpReFePt(μ3-C==CHPh)(CO)5[P(OEt)3]2 with ferrocenium tetrafluoroborate were characterized by EPR spectroscopy.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Zhou, Jun, Rong, Ximing, Molokeev M. S., Wang, Yulong, Yun, Xiangyan, Xu, Denghui, Li, Xiong
Заглавие : Alloying Cs+ into Rb2ZrCl6:Te4+ toward highly efficient and stable perovskite variants
Коллективы : Beijing Natural Science FoundationBeijing Natural Science Foundation [2214068]; National Natural Science Foundation of ChinaNational Natural Science Foundation of China (NSFC) [61705003]; Beijing Technology and Business University Research Team Construction Project [PXM2019_014213_000007, PXM2020_014213_000017]
Место публикации : Mat. Chem. Front. - 2021. - Vol. 5, Is. 13. - P.4997-5003. - ISSN 2052-1537(eISSN), DOI 10.1039/d1qm00302j
Примечания : Cited References: 37. - This work is supported by Beijing Natural Science Foundation (No. 2214068), the National Natural Science Foundation of China (No. 61705003), and the Beijing Technology and Business University Research Team Construction Project (No. PXM2019_014213_000007 and PXM2020_014213_000017)
Предметные рубрики: TELLER
PHOTOLUMINESCENCE
TELLURIUM(IV)
COMPLEXES
PHOSPHORS
Аннотация: Doping or alloying in perovskites and perovskite variants provides a promising way for modulating the electronic and photoluminescence properties and the structural stability. In this work, a series of yellow-emitting Rb2−xCsxZrCl6:Te4+ solid solution phosphors were prepared by a hydrothermal method, and their broad emission is assigned to the triplet 3P1–1S0 self-trapped excitons (STEs). Upon increasing the alloying ion Cs+, the yellow emission can be greatly enhanced by a stronger Jahn–Teller distortion. Moreover, Cs2ZrCl6:Te4+ shows a high photoluminescence quantum yield (PLQY), and impressive thermal and anti-water stability. This doping–alloying strategy presents a new direction towards designing lead-free, high-performance and stable perovskite derivatives.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Shakirova A. A., Tomilin F. N., Pomogaev V. A., Vnukova N. G., Churilov G. N., Kudryasheva N. S., Tchaikovskaya O. N., Ovchinnikov S. G., Avramov P. V.
Заглавие : Synthesis, mass spectroscopy detection, and density functional theory investigations of the Gd endohedral complexes of C82 fullerenols
Коллективы : RFBRRussian Foundation for Basic Research (RFBR) [18-29-19003 MK]; Russian Ministry of Science and EducationMinistry of Education and Science, Russian Federation [0721-2020-0033]; Collaborative NRF-RFBR grant (Korean) [NRF-2019K2A9A1A06100125]; Collaborative NRF-RFBR grant (Russian) [19-53-51005 NIFa RFFI-Korea]; NRF [2021R1A2C1010455]
Место публикации : Computation. - 2021. - Vol. 9, Is. 5. - Ст.58. - ISSN 2079-3197(eISSN), DOI 10.3390/computation9050058
Примечания : Cited References: 41. - The experimental results were funded by RFBR project No. 18-29-19003 MK. The quantum chemical study was funded by project 0721-2020-0033 of the Russian Ministry of Science and Education. The collaboration and coordination of Russian and Korean teams was supported by Collaborative NRF-RFBR grant (Korean ID: NRF-2019K2A9A1A06100125; Russian ID: Project No. 19-53-51005 NIFa RFFI-Korea) and NRF 2021R1A2C1010455 grant
Предметные рубрики: ZETA VALENCE QUALITY
BIOLOGICAL-ACTIVITY
BASIS-SETS
TOXICITY
Аннотация: Gd endohedral complexes of C82 fullerenols were synthesized and mass spectrometry analysis of their composition was carried out. It was established that the synthesis yields a series of fullerenols Gd@C82Ox(OH)y (x = 0, 3; y = 8, 16, 24, 36, 44). The atomic and electronic structure and properties of the synthesized fullerenols were investigated using the density functional theory calculations. It was shown that the presence of endohedral gadolinium increases the reactivity of fullerenols. It is proposed that the high-spin endohedral fullerenols are promising candidates for application in magnetic resonance imaging.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Chudin O. S., Verpekin V. V., Kondrasenko A. A., Burmakina G. V., Piryazev D. A., Vasiliev A. D., Pavlenko N. I., Zimonin D. V., Rubaylo A. I.
Заглавие : Chemistry of vinylidene complexes. XXV. Synthesis and reactions of binuclear µ-vinylidene RePt complexes containing phosphite ligands. Spectroscopic, structural and electrochemical study
Место публикации : Inorg. Chim. Acta. - 2020. - Vol. 505. - Ст.119463. - ISSN 00201693 (ISSN), DOI 10.1016/j.ica.2020.119463
Примечания : Cited References: 56. - This work was conducted within the framework of the budget project AAAA-A17-117021310221-7 for Institute of Chemistry and Chemical Technology SB RAS using the equipment of Krasnoyarsk Regional Research Equipment Centre of SB RAS
Аннотация: Reactions of Cp(CO)2ReCCHPh with Pt[P(OR)3]4 (R = Pri, Et, Ph) gave binuclear μ-vinylidene complexes Cp(CO)2RePt(μ-CCHPh)[P(OR)3]2. Treatment of the previously synthesized Cp(CO)2Re(μ-CCHPh)Pt(PPh3)2 with triisopropylphosphite or triethylphosphite resulted in a stepwise substitution of PPh3 ligands, leading to the disubstituted Cp(CO)2RePt(μ-CCHPh)[P(OR)3]2 and monosubstituted Cp(CO)2RePt(μ-CCHPh)[P(OR)3](PPh3) (R = Pri or Et) species, while no triphenylphosphine ligand substitution in the reaction with P(OPh)3 occurs at all. The monosubstituted Cp(CO)2RePt(μ-CCHPh)[P(OR)3](PPh3) (R = Pri, Et, Ph) species were also obtained by reacting Cp(CO)2ReCCHPh with mixed-ligand complexes Pt(PPh3)3L (L = P(OPri)3, P(OEt)3, P(OPh)3). Reactions of Cp(CO)2RePt(μ-CCHPh)LL′ (L = L′ = P(OPri)3, P(OEt)3, P(OPh)3; L = P(OPri)3, P(OEt)3, P(OPh)3, L′ = PPh3) with Co2(CO)9 yield tricarbonyl vinylidene species Cp(CO)2RePt(μ-CCHPh)[P(OR)3](CO) (R = Pri, Et, Ph). The obtained compounds were characterized by IR and 1H, 13C, 31P NMR spectroscopy. The molecular structures of Cp(CO)2RePt(μ-CCHPh)[P(OPri)3]2, Cp(CO)2RePt(μ-CCHPh)[P(OPri)3](PPh3) and Cp(CO)2RePt(μ-CCHPh)[P(OPri)3](CO) were determined by X-ray diffraction study. The redox properties of the new complexes and their reactions of chemical oxidation were studied.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Verpekin, Victor V., Semeikin, Oleg, V, Vasiliev A. D., Kondrasenko, Alexander A., Belousov Yu. A., Ustynyuk, Nikolai A.
Заглавие : Catalyzed M–C coupling reactions in the synthesis of σ-(pyridylethynyl)dicarbonylcyclopentadienyliron complexes
Коллективы : Russian Science FoundationRussian Science Foundation (RSF) [18-73-00150]
Место публикации : RSC Adv. - 2020. - Vol. 10, Is. 29. - P.17014-17025. - ISSN 2046-2069(eISSN), DOI 10.1039/d0ra02333g
Примечания : Cited References: 86. - This research was funded by a grant from the Russian Science Foundation (project No. 18-73-00150).
Предметные рубрики: NONLINEAR-OPTICAL PROPERTIES
METAL ALKYNYL COMPLEXES
CARBON BOND FORMATION
Аннотация: The reactions between terminal ethynylpyridines, (trimethylsilyl)ethynylpyridines and cyclopentadienyliron dicarbonyl iodide were studied under Pd/Cu-catalyzed conditions to develop a synthetic approach to the σ-alkynyl iron complexes Cp(CO)2Fe–C≡C–R (R = ortho-, meta-, para-pyridyl). Depending on the catalyst and reagents used, the yields of the desired σ-pyridylethynyl complexes varied from 40 to 95%. In some cases the reactions with ortho-ethynylpyridine gave as byproduct the unexpected binuclear FePd μ-pyridylvinylidene complex [Cp(CO)Fe{μ2-η1(Cα):η1(Cα)-κ1(N)-Cα=Cβ(H)(o-C5H4N)}(μ-CO)PdI]. The conditions, catalysts, and reagents that provide the highest yields of the desired σ-pyridylethynyl iron compounds were determined. The methods developed allowed the synthesis of the corresponding σ-4-benzothiadiazolylethynyl complex Cp(CO)2Fe–C≡C–(4-C6H3N2S) as well. Eventually, synthetic approaches to σ-alkynyl iron complexes of the type Cp(CO)2Fe–C≡C–R (R = ortho-, meta-, para-pyridyl, 4-benzothiadiazol-2,1,3-yl) based on the Pd/Cu-catalyzed cross-coupling reactions were elaborated.
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10.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Sukhikh, Taisiya S., Khisamov, Radmir M., Bashirov D. A., Komarov, Vladislav Yu, Molokeev M. S., Ryadun, Alexey A., Benassi E., Konchenko, Sergey N.
Заглавие : Tuning of the coordination and emission properties of 4-amino-2,1,3-benzothiadiazole by introduction of diphenylphosphine group
Коллективы : Russian Science FoundationRussian Science Foundation (RSF) [19-73-00030]; RFBRRussian Foundation for Basic Research (RFBR) [19-52-80003]
Место публикации : Cryst. Growth Des. - 2020. - Vol. 20, Is. 9. - P.5796-5807. - ISSN 1528-7483, DOI 10.1021/acs.cgd.0c00406. - ISSN 1528-7505(eISSN)
Примечания : Cited References: 58. - This work is supported by the Russian Science Foundation (project no. 19-73-00030) and partly by RFBR (viz., powder XRD data processing and determination of the structure of 1. CINF7/INFHINF8/INF using powder XRD) according to the research project no. 19-52-80003. We acknowledge the European Synchrotron Radiation Facility for provision of synchrotron radiation facilities and thank Prof. Andrew N. Fitch. We are grateful to Siberian Supercomputer Centre of Institute of Computational Mathematics and Mathematical Geophysics for computational capability and thank the technical staff of the Institute for the assistance
Предметные рубрики: COMPLEXES
BENZOTHIADIAZOLE
CHEMISTRY
SUBSTITUENTS
LIGANDS
PROGRAM
Аннотация: A novel amino-benzothiadiazole bearing diphenylphosphine groups (L) was designed and synthesized. A number of its coordination compounds of Cu(I) (1·0.75C7H8, 2a,b), Pd(II) (4), and Pt(II) (5) were prepared demonstrating the coordination of L ligand via N and/or P atoms. The reaction with strong Lewis acid Zn(II) resulted in the rearrangement of P—N—P to P–P–N moiety and formation of complex 3. The structures of L, 2–5 were determined by single crystal X-ray (XRD) diffraction, while that of 1·0.75C7H8 was determined by powder XRD analysis. Intermolecular secondary bonding of S···S interactions in the compounds, unusual for benzothiadiazoles, was discussed supported by quantum chemical calculations. Differences in the structures of the compounds cause significant changes of photophysical properties. In particular, the position of the electronic absorption band is featured by the conformation of L, viz., the dihedral angle between the benzothiadiazole unit and the P—N—P moiety, as proved by TD-DFT calculations performed on model molecules. The photophysical properties of the compounds also strongly depend on the coordination mode of L: the presence of a bond between the metal and the N atom of the thiadiazole unit plays an essential role in defining the position of the absorption and emission bands as well as emission lifetime of these compounds. The thermally activated delayed fluorescence and phosphorescence mechanisms in a thermal equilibrium were determined for 1·0.75C7H8. Complex 5 features a broad emission band spanning the entire visible region; moreover, it shows an unusual clear-white luminescence, which remains visible even in the daylight.
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11.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Perlepe, Panagiota, Oyarzabal, Itziar, Mailman, Aaron, Yquel, Morgane, Platunov M. S., Dovgaliuk, Iurii, Rouzieres, Mathieu, Negrier, Philippe, Mondieig, Denise, Suturina, Elizaveta A., Dourges, Marie-Anne, Bonhommeau, Sebastien, Musgrave, Rebecca A., Pedersen, Kasper S., Chernyshov, Dmitry, Wilhelm, Fabrice, Rogalev, Andrei, Mathoniere, Corine, Clerac, Rodolphe
Заглавие : Metal-organic magnets with large coercivity and ordering temperatures up to 242°C
Коллективы : University of Bordeaux; Region Nouvelle AquitaineRegion Nouvelle-Aquitaine; Quantum Matter Bordeaux; Centre National de la Recherche Scientifique (CNRS)Centre National de la Recherche Scientifique (CNRS); Basque GovernmentBasque Government; VILLUM FONDEN [15374]; Academy of FinlandAcademy of Finland [289172]
Место публикации : Science. - 2020. - Vol. 370, Is. 6516. - P.587-591. - ISSN 0036-8075, DOI 10.1126/science.abb3861. - ISSN 1095-9203(eISSN)
Примечания : Cited References: 42. - This work was supported by the University of Bordeaux, the Region Nouvelle Aquitaine, Quantum Matter Bordeaux, and the Centre National de la Recherche Scientifique (CNRS). I.O. and R.C. are grateful to the Basque Government for I.O.'s postdoctoral grant. K.S.P. thanks the VILLUM FONDEN for a Villum Young Investigator grant (15374). A.M. thanks JYU and the Academy of Finland (project 289172) for support
Предметные рубрики: ROOM-TEMPERATURE
CHROMIUM
FERROMAGNETISM
DIFFRACTION
COMPLEXES
Аннотация: Magnets derived from inorganic materials (e.g., oxides, rare-earth–based, and intermetallic compounds) are key components of modern technological applications. Despite considerable success in a broad range of applications, these inorganic magnets suffer several drawbacks, including energetically expensive fabrication, limited availability of certain constituent elements, high density, and poor scope for chemical tunability. A promising design strategy for next-generation magnets relies on the versatile coordination chemistry of abundant metal ions and inexpensive organic ligands. Following this approach, we report the general, simple, and efficient synthesis of lightweight, molecule-based magnets by postsynthetic reduction of preassembled coordination networks that incorporate chromium metal ions and pyrazine building blocks. The resulting metal-organic ferrimagnets feature critical temperatures up to 242°C and a 7500-oersted room-temperature coercivity.
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12.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Lupu, Loredana, Wiegand, Pascal, Huttmann N., Rawer, Stephan, Kleinekofort, Wolfgang, Shugureva, Irina, Kichkailo, Anna S., Tomilin F. N., Lazarev, Alexander, Berezovski, Maxim V., Przybylski, Michael
Заглавие : Molecular epitope determination of aptamer complexes of the multidomain protein C-met by proteolytic affinity-mass spectrometry
Коллективы : LOEWE-3 Funding Agency, Hessen-Agentur, Wiesbaden, Germany [696/19-16]
Место публикации : ChemMedChem. - 2020. - Vol. 15, Is. 4. - P.363-369. - ISSN 1860-7179, DOI 10.1002/cmdc.201900489. - ISSN 1860-7187(eISSN)
Примечания : Cited References: 40. - We gratefully acknowledge the advice and assistance of Prof. Friedemann Volklein and Oliver Muller, MSc in the preparation of chips for the SPR affinity determinations. We thank Dr. Stefan Maeser, Biogen GmbH, Munchen, for valuable advice and critical reading of the manuscript. This work has been partially funded (Chip-MS epitope analysis) by the LOEWE-3 Funding Agency, Hessen-Agentur, Wiesbaden, Germany; Grant 696/19-16
Предметные рубрики: DNA APTAMERS
ANTIBODIES
RECOGNITION
Аннотация: C‐Met protein is a glycosylated receptor tyrosine kinase of the hepatocyte growth factor (HGF), composed of an α and a β chain. Upon ligand binding, C‐Met transmits intracellular signals by a unique multi‐substrate docking site. C‐Met can be aberrantly activated leading to tumorigenesis and other diseases, and has been recognized as a biomarker in cancer diagnosis. C‐Met aptamers have been recently considered a useful tool for detection of cancer biomarkers. Herein we report a molecular interaction study of human C‐Met expressed in kidney cells with two DNA aptamers of 60 and 64 bases (CLN0003 and CLN0004), obtained using the SELEX (Systematic Evolution of Ligands by Exponential Enrichment) procedure. Epitope peptides of aptamer‐C‐Met complexes were identified by proteolytic affinity‐mass spectrometry in combination with SPR biosensor analysis (PROTEX‐SPR‐MS), using high‐pressure proteolysis for efficient digestion. High affinities (KD, 80–510 nM) were determined for aptamer‐C‐Met complexes, with two‐step binding suggested by kinetic analysis. A linear epitope, C‐Met (381–393) was identified for CLN0004, while the CLN0003 aptamer revealed an assembled epitope comprised of two peptide sequences, C‐Met (524–543) and C‐Met (557–568). Structure modeling of C‐Met‐aptamers were consistent with the identified epitopes. Specificities and affinities were ascertained by SPR analysis of the synthetic epitope peptides. The high affinities of aptamers to C‐Met, and the specific epitopes revealed render them of high interest for cellular diagnostic studies.
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13.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Golovnev N. N., Molokeev M. S., Sterkhova I. V., Lesnikov M. K., Demina A. V., Patrin G. S.
Заглавие : Two new Cu(II) and Ni(II) 1,10-phenanthroline complexes with anions of barbituric acids in the outer sphere: Synthesis, structure, spectroscopic, magnetic and thermal properties
Место публикации : J. Mol. Struct. - 2020. - Vol. 1219. - Ст.128526. - ISSN 00222860 (ISSN), DOI 10.1016/j.molstruc.2020.128526
Примечания : Cited References: 40. - The study was funded by RFBR according to the research project № 19-52-80003 . X-ray data from single crystals were obtained with use the analytical equipment of Baikal Center of collective use of SB RAS and powder pattern were obtained with use the analytical equipment of Krasnoyarsk Center of collective use of SB RAS
Аннотация: Two new complexes [Cu(Phen)2(H2O)](Hba)2∙3H2O (1) and [Ni(Phen)3](Htba)2]∙Phen∙2H2O (2) (Phen = 1,10-phenanthroline, Hba− = barbiturate ion, Htba− = thiobarbiturate ion) have been synthesized and characterized by elemental analysis, single-crystal and powder XRD, magnetic measurements, TG-DSC, FT-IR, and Vis absorption spectra. Complex 1 shows a distorted square pyramidal geometry around the copper (II) metal center. The coordination around the Ni atom is a distorted octahedron NiN6. The 3D and 2D supramolecular structures of 1 and 2 are formed respectively by intermolecular H-bonds. Two N–H⋯O hydrogen bonds in 1, and N–H⋯O, N–H⋯S hydrogen bonds in 2 form infinite chains. As a result of π–π interactions, similar 4-membered zigzag chains in structures 1 and 2 respectively are formed.
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14.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Верпекин, Виктор Васильевич, Васильев, Александр Дмитриевич, Павленко, Нина Ивановна, Зимонин, Дмитрий Валерьевич, Бурмакина, Галина Вениаминовна
Заглавие : Реакции фенилацетиленидных комплексов золота (i) и фенилвинилиденов марганца и рения
Коллективы : Полифункциональные химические материалы и технологии, Томский государственный университет
Место публикации : Полифункциональные химические материалы и технологии: матер. междунар. науч. конф. : в 2-х т. - 2019. - Т. 1. - С. 172-173. - ISBN 978-5-6042143-9-8
Примечания : Исследование выполнено при финансовой поддержке Российского фонда фундаментальных исследований, Правительства Красноярского края, Красноярского краевого фонда науки в рамках научного проекта «Новые соединения на основе золота и благородных металлов: синтез, физико-химические свойства, каталитическая способность» (грант №18-43-240010)
Аннотация: A reactivity of gold phenylacetylides (L)Au-C=C-Ph (L = SMe2, C4H8S, C5H5N) towards the vinylidene complexes of rhenium and manganese containing a metallaallene system M=C=C are studied for the first time.
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15.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Smolyarov K. T., Volkov N. V., Matsulev A. N., Kondrasenko A. A.
Заглавие : The comparative analysis of the solid-state 31P NMR spectra of Re-Pt vinylidene complexes
Коллективы : International Scientific Conference "Conference on Applied Physics, Information Technologies and Engineering"
Место публикации : J. Phys. Conf. Ser. - 2019. - Vol. 1399. - Ст.022028. - ISSN 1742-6588, DOI 10.1088/1742-6596/1399/2/022028. - ISSN 1742-6596 (eISSN)
Примечания : Cited References: 11
Предметные рубрики: Applied Physics
Аннотация: The two vinylidene complexes Cp(CO)2 RePt(μ-C=CHPh)(PPh3 )(CO) and Cp(CO)2 RePt(μ-C=CHPh)(PPh3 )2 and their precursors PPh3 and P(PPh3 )4 were studied by solid-state nuclear magnetic resonance. We analysed 31P cross-polarization spectra acquired in static conditions and with magic angle spinning. The chemical shift tensors of each sample were determined by fitting their spectra using SIMPSON simulations.
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16.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Ma, Xiaozhou, Suturina, Elizaveta A., Rouzieres, Mathieu, Platunov M. S., Wilhelm, Fabrice, Rogalev, Andrei, Clerac, Rodolphe, Dechambenoit, Pierre
Заглавие : Using Redox-Active pi Bridging Ligand as a Control Switch of Intramolecular Magnetic Interactions
Коллективы : ANRFrench National Research Agency (ANR) [ANR-16-CE29-0001-01]; University of Bordeaux; Region Nouvelle Aquitaine; CNRSCentre National de la Recherche Scientifique (CNRS); MOLSPIN COST actionEuropean Cooperation in Science and Technology (COST) [CA15128]; Chinese Scholarship Council (CSC)China Scholarship Council; EPSRCEngineering & Physical Sciences Research Council (EPSRC) [EP/N006895/1]; IRIDIS High Performance Computing Facility; University of Southampton; RSC
Место публикации : J. Am. Chem. Soc. - 2019. - Vol. 141, Is. 19. - P.7721-7725. - ISSN 0002-7863, DOI 10.1021/jacs.9b03044
Примечания : Cited References: 38. - This work was supported by the ANR (ANR-16-CE29-0001-01, Active-Magnet project), the University of Bordeaux, the Region Nouvelle Aquitaine, the CNRS, the MOLSPIN COST action CA15128 and the Chinese Scholarship Council (CSC) for the PhD funding of X.M. E.A.S. thanks EPSRC for support (EP/N006895/1), the IRIDIS High Performance Computing Facility and associated services at the University of Southampton and RSC for travel grant. The authors thank also S. De, D. Woodruff, P. Perlepe, I. Oyarzabal, and S. Exiga for their assistance and fruitful discussions as well as the GdR MCM-2.
Предметные рубрики: GROUND-STATE
COMPLEXES
Аннотация: Intramolecular magnetic interactions in the dinuclear complexes [(tpy)Ni(tphz)Ni(tpy)]n+ (n = 4, 3, and 2; tpy, terpyridine; tphz, tetrapyridophenazine) were tailored by changing the oxidation state of the pyrazine-based bridging ligand. While its neutral form mediates a weak antiferromagnetic (AF) coupling between the two S = 1 Ni(II), its reduced form, tphz•–, promotes a remarkably large ferromagnetic exchange of +214(5) K with Ni(II) spins. Reducing twice the bridging ligand affords weak Ni–Ni interactions, in marked contrast to the Co(II) analogue. Those experimental results, supported by a careful examination of the involved orbitals, provide a clear understanding of the factors which govern strength and sign of the magnetic exchange through an aromatic bridging ligand, a prerequisite for the rational design of strongly coupled molecular systems and high TC molecule-based magnets.
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17.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Верпекин, Виктор Васильевич, Васильев, Александр Дмитриевич, Павленко, Нина Ивановна, Семейкин О. В., Крейндлин А. З.
Заглавие : Синтез алкинильных комплексов циклопентадиенилдикарконил железа в условиях реакций pd/cu-катализируемого m-c сочетания
Коллективы : Полифункциональные химические материалы и технологии, Томский государственный университет
Место публикации : Полифункциональные химические материалы и технологии: матер. междунар. науч. конф. : в 2-х т. - 2019. - Т. 1. - С. 174-175. - ISBN 978-5-6042143-9-8
Примечания : Исследование выполнено за счет гранта Российского научного фонда (проект № 18-73-00150)
Аннотация: Reactions between cyclopentadienyliron dicarbonyl iodide and terminal alkynes containing such substituents as ortho-, meta-, para-pyrydyl, 2-thiophenyl, 2,1,3-benzothiadiazole in condition of Pd/Cu-catalyzed cross-coupling are studied. New synthetic methods for о-alkynyl iron complexes are developed.
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18.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Golovnev N. N., Molokeev M. S., Sterkhova I. V., Lesnikov M. K.
Заглавие : Structure of Barbituratobis(2,2'-Dipyridyl)copper(II) Heptahydrate
Коллективы : Ministry of Education and Science of the Russian Federation [4.7666.2017/BCh]
Место публикации : Russ. J. Coord. Chem. - 2019. - Vol. 45, Is. 8. - P.569-572. - ISSN 1070-3284, DOI 10.1134/S1070328419080037. - ISSN 1608-3318(eISSN)
Примечания : Cited References: 25. - This work was supported by the Ministry of Education and Science of the Russian Federation in the framework of the state task for the Siberian Federal University for 2017-2019 (4.7666.2017/BCh).
Предметные рубрики: IONIC CO-CRYSTALS
BARBITURIC-ACID
COMPLEXES
STATE
Аннотация: The structure of the complex [Cu(Bipy)2(BA)] ∙ 7H2O (I), where Bipy is 2,2'-dipyridyl, and BA2– is the barbituric acid anion (H2BA), is determined (CIF file CCDC no. 1887338). The thermal decomposition and IR spectrum of complex I are studied. The crystals are orthorhombic: a = 26.118(3), b = 27.685(3), c = 15.683(2) Å, V = 11 370(2) Å3, space group Fdd2, Z = 16. The discrete structure of the polar crystal consists of neutral [Cu(Bipy)2(BA)] particles and molecules of crystallisation water . The Cu2+ ion is bound to the N atoms of two bidentate Bipy molecules and the N atom of the BA2− ion at the vertices of the trigonal bipyramid CuN5. Compound I is the first example of the metal complex only with the N-coordinated anions of barbituric acid (BA2−, НBA−). The structure is stabilized by hydrogen bonds O−H∙∙∙O and N−H∙∙∙O to form a three-dimensional network with the π–π interaction between the Bipy molecules. The compound begins to lose water at ~50°С and is completely dehydrated above 200°С.
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19.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Verpekin V. V., Vasiliev A. D., Kondrasenko A. A., Burmakina G. V., Chudin O. S., Pavlenko N. I, Zimonin, Dmitry V., Rubaylo, Anatoly I.
Заглавие : Chemistry of vinylidene complexes. XXIV. A new μ-vinylidene complex containing RePt core, and platinum-bound carbonyl ligand. Spectroscopic, structural and electrochemical study
Коллективы : Russian Academy of Sciences [V.44.1.7]; Krasnoyarsk Region Science and Technology Support Fund [3/15]
Место публикации : J. Mol. Struct. - 2018. - Vol. 1163. - P.308-315. - ISSN 0022-2860, DOI 10.1016/j.molstruc.2018.03.020. - ISSN 1872-8014(eISSN)
Примечания : Cited References: 45. - The reported study was funded by the State budget allocated to the fundamental research in the Russian Academy of Sciences in the framework of Project No. V.44.1.7 and was financially supported by Krasnoyarsk Region Science and Technology Support Fund (the junior scientists project no. 3/15).
Предметные рубрики: TRI-METAL COMPLEXES
RAY CRYSTAL-STRUCTURE
BRIDGING CARBENE
CARBYNE
Ключевые слова (''Своб.индексиров.''): rhenium--platinum--vinylidene complexes--heterometallic complexes--electrochemistry
Аннотация: The novel heterobinuclear μ-vinylidene complex [Cp(CO)2Re(μ-C=CHPh)Pt(PPh3)(CO)] (1) was isolated from the reaction mixture of [Cp(CO)2Re(μ-C=CHPh)Fe(CO)4] and Pt(PPh3)4 for the first time. Alternative high-yield synthetic approaches to 1 were developed including the reactions of [Cp(CO)2Re(μ-C=CHPh)Pt(PPh3)2] (2) with Co2(CO)8 and Rh(acac)(CO)2. The complex was characterized by IR and ¹H, ¹³C and ³¹P NMR spectroscopy, a molecular structure of 1 was determined by X-ray diffraction analysis. The electrochemical behavior of the new complex was studied by cyclic voltammetry at platinum or glassed carbon electrodes and by dc polarography at a dropping mercury electrode.
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20.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Golovnev N. N., Molokeev M. S., Sterkhova I. V., Lesnikov M. K.
Заглавие : Two novel mixed-ligand Ni(II) and Co(II) complexes with 1,10-phenanthroline: Synthesis, structural characterization, and thermal stability
Место публикации : Chem. Phys. Lett. - 2018. - Vol. 708. - P.11-16. - ISSN 00092614 (ISSN), DOI 10.1016/j.cplett.2018.07.058
Примечания : Cited References: 29. - The study was carried out within the public task of the Ministry of Education and Science of the Russian Federation to the Siberian Federal University (4.7666.2017/BP) in 2017-2019. X-ray data from single crystals were obtained with use the analytical equipment of Baikal Center of collective use of SB RAS and with use the analytical equipment of Krasnoyarsk Center of collective use of SB RAS.
Ключевые слова (''Своб.индексиров.''): barbituric acid--1,10-phenanthroline complexes--x-ray diffraction--thermal decomposition--infrared spectroscopy
Аннотация: Two nickel(II) and cobalt(II) complexes with phenanthroline, [Ni(Phen)(H2O)3Br]Br (1) and [Co(Phen)2(H2O)2](Hba)2·2H2O (2), Phen = 1,10-phenanthroline and Hba− = barbiturate anion, were synthesized and characterized by powder XRD, TGA and FT-IR. Their structures were determined by single crystal X-ray diffraction techniques. The Ni2+ ion is coordinated by two N atoms of Phen molecule, Br− ion and three H2O molecules forming an octahedron. Uncoordinated and coordinated Br− ions are connected with water molecules by OH⋯Br intermolecular hydrogen bonds with the formation of a 2D plane network which is extended into a 3D network by π−π stacking interactions. The [Co(Phen)2(H2O)2]2+ cation contains a six-coordinated cobalt atom chelated by two Phen ligands and two aqua ligands in the cis arrangement. NH⋯O, OH⋯O and CH⋯O intermolecular hydrogen bonds form a 3D net. NH⋯O hydrogen bonds form the infinite chains of Hba–. In addition, coordinated Phen molecules and lattice water molecules are linked via CH⋯OW hydrogen bonds to form infinite zigzag chains. These different chains are connected by OWH⋯O hydrogen bonds. π−π interaction plays an important role in the stabilization of structures 1–2. FT-IR, TGA, the diffuse reflectance, and UV–Vis spectra were also used to characterize these compounds.
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