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Lanthanide Complexes with 1,4,7-Trimethyl-1,4,7-triazacyclononane
Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya. 2024. Vol. 50. No. 4. P. 292–299.
The reaction of 1,4,7-trimethyl-1,4,7-triazacyclononane with samarium, gadolinium, and terbium
chloride tetrahydrofuranates gives mononuclear complexes [LnCl3(Me3tacn)(THF)n] (Me3tacn = 1,4,7-
trimethyl-1,4,7-triazacyclononane; Ln = Sm (I), Gd (II), n = 1; Ln = Tb (III), n = 0). The treatment of
complexes I or II with 1,2,4-triphenylcyclopentadienyl potassium affords mono(cyclopentadienyl) complexes
[CpPh3LnCl2(Me3tacn)] (CpPh3 = 1,2,4-triphenylcyclopentadienyl; Ln = Sm (IV), Gd (V)). Complexes
IV and V are formed even when a twofold excess of CpPh3K is used. The molecular structure of complexes
I–V was established by X-ray diffraction analysis (CCDC nos. 2299485 (I), 2299487 (II), 2299486
(III), 2305352 (IV), 2306051 (V)).
Makarov D. M., Kalikin N., Fashchevsky K. A. et al., Electrochimica Acta 2026 Vol. 579 Article 150159
Machine learning (ML) has become a powerful tool for accelerating the development of carbon-based supercapacitors;
however, most published models assume that a single predictive framework can describe both conventional
porous carbons and hybrid carbon electrodes. Here, we test this assumption using a comprehensive
benchmark dataset and an extended literature-curated dataset enriched with synthesis- and electrolyte-related
descriptors. Three ML algorithms ...
Added: October 13, 2026
Shi R., Yu Y., Chibisov A., International Journal of Hydrogen Energy 2025 Vol. 107 P. 52–62
Cyanide containing wastewater can cause livestock death and reduce agricultural production and electrochemical reduction of cyanide (CNRR) is a promising way to eliminate its harm and turn waste into valuable products. However, the reaction mechanism and function of electrocatalysts for CNRR have not been fully understood yet. Herein we identify a two-dimensional (2D) conductive copper-organic ...
Added: October 11, 2026
Zhukov A., Chen F., Zeng Y. et al., Nanoscale 2026 Vol. 18 No. 36 P. 19223–19253
Colloidal semiconductor nanocrystals have emerged as promising materials for next-generation light-emitting diodes (LEDs) owing to their solution processability, tunable emission wavelengths, narrow emission linewidths, and high photoluminescence quantum yields. Among them, anisotropic nanocrystals, including one-dimensional nanorods (NRs) and two-dimensional nanoplatelets (NPLs), offer additional opportunities for controlling transition dipole moment orientation and light out-coupling efficiency. These ...
Added: October 2, 2026
Мальцева В. Е., Ananyev I., Milevskii N. et al., Molecular Systems Design and Engineering 2026 Vol. 11 No. 7 P. 691–704
The use of hydrophobic deep eutectic solvents (DESs) as extractants for metal ion separation is largely due to the ease of their preparation and the possibility of modifying them depending on the composition of the metal mixture to be separated. However, the most common approach to DES modification involves the replacement of the extractant, while ...
Added: October 2, 2026
Мальцева В. Е., Ananyev I., Golubev A. V. et al., Russian Journal of Inorganic Chemistry 2026 Vol. 71 P. 724–736
Two voluminous polymer silver(I) salts of perchlorinated dodecoborate clusters, {[(Me2CO)Ag(μ-Me2CO)2Ag(Me2CO)][μ-B12Cl12]}n (1) and {[DMFAg(μ-DMF)2AgDMF][μ-B12Cl12]}n (2) were synthesized. The 35Cl nuclear quadrupole resonance (NQR) spectroscopy supplemented with the X-ray diffraction data was applied for identifying and analyzing noncovalent interactions Cl···X in these salts. Whereas in X-ray diffraction, noncovalent interactions are associated with the presence of the shortened ...
Added: October 2, 2026
Мальцева В. Е., Rozhkov A., Ananyev I. et al., Inorganic Chemistry 2026 Vol. 65 No. 22 P. 12484–12496
Despite the well-established importance of chalcogen bonding in crystal engineering and supramolecular chemistry, experimental charge density data for TeII-centered chalcogen bonds have remained entirely absent, leaving the electronic nature of these interactions uncharacterized at the level of directly measured electron density. Here, we report the first high-resolution X-ray diffraction (HRXRD) study of TeII-centered chalcogen bonds, ...
Added: October 2, 2026
Ostovari Moghaddam A., Mehrabi-Kalajahi S., Solizoda I. A. et al., Metals and Materials International 2026 P. 1–9
Off-stoichiometric boron-doped chemically complex intermetallic alloys (CCIMAs) have recently emerged as a new avenue for overcoming the low temperature brittleness of ordered superlattices. However, their behavior at high temperatures remains unexplored. In this study, a novel (Ni39.6Co29.3Cr10Al15.8Ta3.3Nb2)98.5B1.5 CCIMA was prepared and its oxidation resistance over a wide temperature range (500 °C–950 °C) was studied. The ...
Added: October 1, 2026
Kashpurovich I., Oleynichenko A., Stegailov V., Supercomputing Frontiers and Innovations 2026 Vol. 13 No. 1 P. 52–73
We report a high-performance implementation of the resolution-of-the-identity Hartree–Fock method that fully exploits the permutational symmetry of three-center electron repulsion integrals (ERI). The present implementation adopts a hybrid MPI+OpenMP parallelization strategy. Two different algorithmic approaches (with and without the pre-transformation of ERIs) are compared. A custom data layout introduced previously is employed. Designed to efficiently ...
Added: September 28, 2026
Li Y., Han J., Zaman N. et al., ACS Applied Materials & Interfaces 2026 Vol. 18 No. 39 P. 54241–54251
The development of lead sulfide (PbS) quantum dot (QD) photodetectors for short-wave infrared (SWIR) applications has been fundamentally limited by the thermodynamic instability of large PbS QD facets, which leads to aggregation and epitaxial fusion. In this work, robust thermodynamic stabilization was achieved by introducing methylammonium chloride (MACl) in PbS QD surface passivation, as validated ...
Added: September 26, 2026
Metlina D., Metlin M., Korshunov V. et al., Dalton Transactions 2025 Vol. 54 No. 9 P. 3812–3826
We synthesized and investigated a new series of Sm3+ 1,3-diketonate complexes with CnF2n+1-homologous thiophene-containing ligands. A clear correlation was found between the number of fluorine atoms in the 1,3-diketone's carbon chain and the luminescent properties of the samarium(III) complexes. The ligand modification method employed facilitates targeted and significant enhancements in the photoluminescence quantum yield (PLQY). ...
Added: March 24, 2026
Polikovskiy T., Gontcharenko V., Korshunov V. et al., Materials Chemistry Frontiers 2025 Vol. 9 No. 23 P. 3443–3459
Conventional thermal sensors often face limitations due to their reliance on direct contact and restricted measurement ranges, leading to the emergence of novel techniques like luminescence thermometry. However, sensitivity of luminescent thermometers is limited by the only used Boltzmann-based Mott–Seitz model, which is imperfect. To overcome this, we complemented Mott–Seitz model applying machine learning algorithms, ...
Added: March 24, 2026
Baranchikov A., Teplonogova M., Kozlova A. et al., European Journal of Inorganic Chemistry 2026 P. 1–12
Rare earth oxides (RE2O3) were found to react with glycine in an aqueous medium at rather low temperatures (60°С–120°С), forming rare earth oxohydroxyglycinates, RE2O(OH)3(NH2CH2COO)·H2O, with a previously unknown crystal structure. The structure of the europium oxohydroxyglycinate was determined using powder X-ray diffraction. Its layered structure and ability for anion exchange under mild conditions, namely the ...
Added: February 25, 2026
Лунев А. М., Sidoruk A., Gontcharenko V. et al., Inorganica Chimica Acta 2022 Vol. 527 No. 120956
New pyrazole-based carboxylic ligand 1-(carboxymethyl)-1H-pyrazole-3,5-dicarboxylic acid (H3L) as well as its lanthanide complexes [LnL(H2O)2]n, Ln=La (1), Ce (2), Pr (3), Nd (4), Sm (5), Eu (6), Gd (7), Tb (8) and [LnL(H2O)]n, Ln= Dy (9), Ho (10), Er (11), Tm (12), Yb (13), Lu (14) have been prepared and studied. Compounds 1-8 represent a 3D ...
Added: January 13, 2026
Ivanova A., Gontcharenko V., Lunev A. et al., Inorganics 2022 Vol. 10 No. 8 Article 104
Two new compounds, namely {(NMe2H2)}[Ln(TDA)(HCOO)] 0.5H2O, Ln = Sm3+ (Sm-TDA) and Gd3+ (Gd-TDA), where TDA3− is the anion of 1H-1,2,3-triazole-4,5-dicarboxylic acid (H3TDA), were synthesized by the solvothermal method in a DMF:H2O mixture. According to single-crystal X-ray diffraction data, the compounds are 3d-MOFs with an anionic lattice and dimethylammonium cations occupying part of the cavities. Based ...
Added: January 13, 2026
D. A. Bardonov, K. A. Lysenko, I. E. Nifantiev et al., Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya 2025 Vol. 51 No. 3 P. 211– 217
in the presence of 1,3,5-trimethyl-1,3,5-triazacyclohexane (Me3tach) gives complexes of the
type [Cp'Y(Me3tach)Cl2] (Cp' = Ph2C5H3 (CpPh2) (I), Ph3C5H2 (CpPh3) (II), Ph4C5H (CpPh4) (III). The
molecular structure of complexes I–III was established by X-ray diffraction (CCDC nos. 2406644 (I),
2406645 (II), 2406646 (III)). The main structural parameters of all of the obtained monocyclopentadienyl
complexes were similar, irrespective of the number ...
Added: November 9, 2025
Ivanova A., Polikovskiy T., Victoria E. Gontcharenko et al., Sensors and Actuators, A: Physical 2024 Vol. 379 Article 115969
Luminescence thermometry, leveraging the temperature-dependent luminescent properties of coordination compounds, offers precise and remote temperature measurement. However, many existing luminescent thermometers exhibit a narrow peak in temperature sensitivity, restricting their effective operating range. In this study, we synthesized new complexes [LnL2(NO3)(TPPO)2], where Ln = Eu (1), Tb (2), Gd (3), Tb0.94Eu0.06 (4), (HL - 4,4,4-trifluoro-1-(furan-2-yl) ...
Added: November 22, 2024
Дегтярева С. С., Бардонов Д. А., Лысенко К. А. et al., Координационная химия 2023 Т. 49 № 8 С. 504–512
reaction of triphenylcyclopentadienyl potassium with praseodymium and erbium chloride tetrahydrofuranates
gives, depending on the reactant ratio, tetranuclear ate complexes, [{(Ph3C5H2)Pr(THF)}2(μ2-Cl)2(μ3-Cl)3K]2(C7H8)4 (I) and [{(Ph3C5H2)Er(THF)}2(μ2-Cl)2(μ3-Cl)3K(THF)]2 (III), or
binuclear ate complexes [(Ph3C5H2)2LnCl(KCl)]2 Ln = Pr (II), Er (IV) (CCDC no. 2224244 (I),
2224243 (II), 2224245 (III), 2224242 (IV)). The structurally similar complexes I and III are based on the
{[Ln2(μ-Cl)3]2(μ-Cl)2K2} core, and ...
Added: January 28, 2024
D. A. Bardonov, Lysenko K. A., I. E. Nifant’ev et al., Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya 2022 Vol. 48 No. 5 P. 295–300
Abstract: The reaction of 1-(o-methoxyphenyl)-3,4-diphenylcyclopentadienyl potassium with gadolinium chloride tetrahydrofuranate gives, depending on the stoichiometry, either tetranuclear complex [{[η5-(Ph2(o-CH3OC6H4)C5H2)Gd(Thf)]2(µ2-Cl)2(µ3-Cl)3K(Thf)}2] (I) or mononuclear complex [(Ph2(o-CH3OC6H4)C5H2)2GdCl] (II) (CIF files CCDC nos. 2116742 (I), 2116741 (II)). In complex I, the oxygen atom of the methoxy group is not coordinated to the gadolinium cation, whereas in complex II, the ...
Added: October 24, 2022
Alexey M.Lunev, Sidoruk A., Victoria E. Gontcharenko et al., Inorganica Chimica Acta 2022 Vol. 527 Article 120956
New pyrazole-based carboxylic ligand 1-(carboxymethyl)-1H-pyrazole-3,5-dicarboxylic acid (H3L) as well as its lanthanide complexes [LnL(H2O)2]n, Ln = La (1), Ce (2), Pr (3), Nd (4), Sm (5), Eu (6), Gd (7), Tb (8) and [LnL(H2O)]n, Ln = Dy (9), Ho (10), Er (11), Tm (12), Yb (13), Lu (14) have been prepared and studied. Compounds 1–8 represent a 3D polymer structure while 9–14 are ...
Added: October 17, 2022
Belousov Y., Drozdov A., Taydakov I. et al., Coordination Chemistry Reviews 2021 Vol. 15 Article 214084
The unique optical and magnetic properties of lanthanide ions (Ln), like a gem, need the right faceting and the right setting. Azole carboxylic acids provide a unique platform for driving the structure of complex compounds ranging in dimensions from 0-D (molecular complexes) to 1-D, 2-D polymers and 3-D MOF (Metal Organic Framework) structures. The peculiarity ...
Added: October 4, 2021
Kalugin A., Minyaev M., Puntus L. et al., Molecules 2020 Vol. 25 No. 17 P. 3934
Organophosphate-chloride complexes [{(2,6-iPr2C6H3-O)2POO}2LnCl(CH3OH)4]2CH3OH,
Ln = Nd (1), Eu (2), Gd (3), and Tb (4) have been obtained and structurally characterized.
Their reaction with 2,20:60,2”-terpyridine leads to the formation of 1:1 adducts ([{(2,6-iPr2C6H3O)2POO}2LnCl(terpy)(H2O)2(CH3OH)], Ln = Eu (5), Gd (6), Tb (7) with exception of Nd, where
tris-diisopropylphenylphosphate complex [{(2,6-iPr2C6H3-O)2POO}3Nd) (terpy)(H2O)(CH3OH)] (8)
was obtained due to the ligand metathesis. A bright ...
Added: October 20, 2020