{"title":"Mechanism of the Formation of trans- and cis-Isomers of the Bis(chelate) Pd(II) and Pt(II) Complexes Based on (N,O(S,Se))-Bidentate Azomethines: A Quantum Chemical Study","authors":"N. N. Kharabayev, D. V. Steglenko, V. I. Minkin","doi":"10.1134/S107032842460058X","DOIUrl":"10.1134/S107032842460058X","url":null,"abstract":"<p>The molecular structures and relative energies of <i>trans-</i> and <i>cis-</i>isomers of bis(chelate) complexes of Pd(II) and Pt(II) salicylal-, thiosalicylal-, and selenosalicylaldiiminates are calculated using the density functional theory. The role of the kinetic factor in the formation of the <i>trans-</i> and <i>cis-</i>isomers of the PdL<sub>2</sub> and PtL<sub>2</sub> complexes is studied in the framework of the model of the step-by-step formation of the bis(ligand) metal complexes ML<sub>2</sub> (M<sup>++</sup> + (L)<sup>–</sup> → (ML)<sup>+</sup>, (ML)<sup>+</sup> + (L)<sup>–</sup>→ ML<sub>2</sub>). The competition of the <i>trans-</i> and <i>cis-</i>isomers of the PdL<sub>2</sub> and PtL<sub>2</sub> bis(chelate) azomethine complexes with the coordination nodes MN<sub>2</sub>O<sub>2</sub>, MN<sub>2</sub>S<sub>2</sub>, and MN<sub>2</sub>Se<sub>2</sub> is shown to be determined by both the energy preference of one of possible configurations and activation barriers of the isomerization of the products formed in the first step of the interaction of the initial reagents.</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 10","pages":"802 - 808"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790350","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Adducts of Sterically Hindered Tellurium Catecholate with N-Methylpyrrolidone","authors":"P. A. Petrov, E. A. Filippova, T. S. Sukhikh","doi":"10.1134/S1070328424600530","DOIUrl":"10.1134/S1070328424600530","url":null,"abstract":"<p>The formation of adducts of tellurium(IV) 3,6-di-<i>tert</i>-butyl catecholate (Te(Cat<sup>36</sup>)<sub>2</sub>) with <i>N</i>-methylpyrrolidone (NMP) is studied. The crystallization from a CH<sub>2</sub>Cl<sub>2</sub>–NMP–aromatic hydrocarbon mixture is found to result in the formation of dimeric complexes [{Te(Cat<sup>36</sup>)<sub>2</sub>}<sub>2</sub>(μ-NMP)(μ-arene)] (arene is C<sub>6</sub>H<sub>6</sub>, C<sub>7</sub>H<sub>8</sub>), whereas mononuclear [Te(Cat<sup>36</sup>)<sub>2</sub>(NMP)<sub>2</sub>] is formed from a CH<sub>2</sub>Cl<sub>2</sub>–NMP–alkane mixture. The formation of the adducts with aromatic hydrocarbons indicates a possibility of using the tellurium complexes for the separation of hydrocarbon mixtures, including an industrially important benzene–cyclohexane mixture.</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 9","pages":"683 - 688"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790289","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Yu. A. Laricheva, Ch. Guan, N. V. Kuratieva, N. F. Romashev, A. L. Gushchin
{"title":"Synthesis and Structure of Manganese Complexes with N,N'-bis[(2,4,6-trimethylphenyl)imino]acenaphthene","authors":"Yu. A. Laricheva, Ch. Guan, N. V. Kuratieva, N. F. Romashev, A. L. Gushchin","doi":"10.1134/S1070328424600578","DOIUrl":"10.1134/S1070328424600578","url":null,"abstract":"<p>Methods for the synthesis of new manganese(II) complexes with <i>N</i>,<i>N</i>'-bis[(2,4,6-trimethylphenyl)iminoacenaphthene (Tmp-bian), [Mn(Tmp-bian)Br<sub>2</sub>] (<b>I</b>), [Mn(Tmp-bian)(EtOH)Br<sub>2</sub>] (<b>Ia</b>), [Mn(Tmp-bian)Cl<sub>2</sub>] (<b>II</b>), [Mn(Tmp-bian)<sub>2</sub>(ClO<sub>4</sub>)<sub>2</sub>] (<b>III</b>), and [Mn(Tmp-bian)<sub>2</sub>(OTs)<sub>2</sub>] (<b>IV</b>) were developed. The obtained compounds were characterized by elemental analysis and IR spectroscopy. The molecular structures of <b>I</b>, <b>Iа</b>, and <b>III</b> were determined by X-ray diffraction (CCDC nos. 233510–233512). The electronic structures of <b>I</b> and <b>III</b> were established by quantum chemical calculations using density functional theory (DFT).</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 9","pages":"662 - 672"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790353","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
A. S. Samulionis, A. G. Medvedev, T. A. Tripol’skaya, M. A. Kiskin, P. V. Prikhodchenko, I. L. Eremenko, S. A. Nikolaevskii
{"title":"Monomerization of Binuclear Complex [Zn2(Piv)4(Phen)2] under the Action of Water","authors":"A. S. Samulionis, A. G. Medvedev, T. A. Tripol’skaya, M. A. Kiskin, P. V. Prikhodchenko, I. L. Eremenko, S. A. Nikolaevskii","doi":"10.1134/S1070328424601006","DOIUrl":"10.1134/S1070328424601006","url":null,"abstract":"<p>The interaction of the binuclear complex [Zn<sub>2</sub>(Рiv)<sub>4</sub>(Рhen)<sub>2</sub>] with water in toluene or acetonitrile results in its monomerization with the formation of compound [Zn(Рiv)<sub>2</sub>(H<sub>2</sub>O)(Рhen)], the crystal structure of which is determined by XRD (CIF file CСDC no. 2374361). The individual character of the formed crystalline phase is confirmed by powder XRD. Nanoparticles of zinc peroxide/hydroxide are proposed to be used as a water source for the obtaining of single crystals of [Zn(Рiv)<sub>2</sub>(H<sub>2</sub>O)(Рhen)] suitable for XRD.</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 10","pages":"866 - 872"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790363","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
E. V. Gorbachuk, M. A. Mikhaylov, D. G. Sheven, M. N. Sokolov, D. G. Yakhvarov
{"title":"Rhenium Iodide Cluster Re3I9 as a Precursor in the Synthesis of [Re(CO)5I] and ((n-C4H9)4N)2[Re2Cl8]","authors":"E. V. Gorbachuk, M. A. Mikhaylov, D. G. Sheven, M. N. Sokolov, D. G. Yakhvarov","doi":"10.1134/S1070328424600463","DOIUrl":"10.1134/S1070328424600463","url":null,"abstract":"<p>The reduction of rhenium iodide cluster Re<sub>3</sub>I<sub>9</sub> to [Re(CO)<sub>5</sub>I] (55% yield) was observed in the presence of concentrated HCl and HCOOH at 130°C. In a dimethylammonium chloride [(CH<sub>3</sub>)<sub>2</sub>NH<sub>2</sub>]Cl melt, the triangular cluster polymer Re<sub>3</sub>I<sub>9</sub> is transformed into the dianionic binuclear cluster complex [Re<sub>2</sub>-Cl<sub>8</sub>]<sup>2–</sup>, which was isolated as the tetrabutylammonium salt ((<i>n</i>-C<sub>4</sub>H<sub>9</sub>)<sub>4</sub>N)<sub>2</sub>[Re<sub>2</sub>Cl<sub>8</sub>] in 46% yield. The structure of the complex [Re(CO)<sub>5</sub>I] was confirmed by powder X-ray diffraction, energy dispersive spectroscopy, IR, and Raman spectroscopy. ((<i>n</i>-C<sub>4</sub>H<sub>9</sub>)<sub>4</sub>N)<sub>2</sub>[Re<sub>2</sub>Cl<sub>8</sub>] was identified using elemental analysis, energy dispersive spectroscopy, and IR and Raman spectroscopy. An acetonitrile solution of ((<i>n</i>-C<sub>4</sub>H<sub>9</sub>)<sub>4</sub>N)<sub>2</sub>[Re<sub>2</sub>Cl<sub>8</sub>] was characterized by the mass spectrum and characteristic UV−Vis spectrum.</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 9","pages":"715 - 720"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790338","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
V. V. Sushev, N. V. Zolotareva, M. D. Grishin, R. V. Rumyantcev, G. K. Fukin, A. N. Kornev
{"title":"Influence of Noncovalent Se∙∙∙Se, N∙∙∙P, and Se∙∙∙H Interactions on the Structures of 1,4-Bis(phenylselenyl)-3a,6a-diaza-1,4-diphosphapentalene in Crystal and Solution","authors":"V. V. Sushev, N. V. Zolotareva, M. D. Grishin, R. V. Rumyantcev, G. K. Fukin, A. N. Kornev","doi":"10.1134/S1070328424600888","DOIUrl":"10.1134/S1070328424600888","url":null,"abstract":"<p>The reaction of annelated 1,4-dichloro-3<i>a</i>,6<i>a</i>-diaza-1,4-diphosphapentalene (DDPCl<sub>2</sub>, <b>I</b>) with 2 equivalents of lithium phenyl selenolate (PhSeLi) results in the substitution of the chlorine atoms by the PhSe group and formation of exclusively <i>cis</i> isomer of annelated 1,4-bis(phenylselenyl)-3<i>a</i>,6<i>a</i>-diaza-1,4-diphosphapentalene (<b>II</b>) according to the XRD data. The noncovalent Se···Se interaction (3.968 Å) is observed in the crystal of compound <b>II</b>. The <i>cis</i>-<b>II</b> isomer is by 6.0 kcal/mol thermodynamically more favorable than <i>trans-</i><b>I</b> according to the DFT/B3LYP/6-31G(d) calculations. The <i>cis</i>-1,4-bis(phenylselenyl) and 1,1-bis(phenylselenyl) isomers (the latter is formed due to the easy migration of the PhSe group) are equilibrated in the solution. Noncovalent N∙∙∙P and Se∙∙∙H interactions participate in the stabilization of the 1,1-isomer. The crystallographic structural information is available at the Cambridge Crystallographic Data Centre (CIF file CCDC no. 2357640).</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 10","pages":"827 - 836"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790352","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
D. A. Bardonov, D. M. Roitershtein, D. I. Nasyrova, M. E. Minyaev
{"title":"Erratum to: Trinuclear Lutetium(III) Cyclopentadienyl Complex with the 2,2'-Bipyridine Dianion","authors":"D. A. Bardonov, D. M. Roitershtein, D. I. Nasyrova, M. E. Minyaev","doi":"10.1134/S107032842409001X","DOIUrl":"10.1134/S107032842409001X","url":null,"abstract":"","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 9","pages":"768 - 768"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790364","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
A. F. Rogozhin, V. A. Ilichev, L. I. Silantyeva, E. A. Kozlova, G. K. Fukin, M. N. Bochkarev
{"title":"Ditopic Centrosymmetric Mercaptobenzothiazole Dilithium Salts: From the Molecular Complex to Luminescent 1D Coordination Polymers","authors":"A. F. Rogozhin, V. A. Ilichev, L. I. Silantyeva, E. A. Kozlova, G. K. Fukin, M. N. Bochkarev","doi":"10.1134/S1070328424600414","DOIUrl":"10.1134/S1070328424600414","url":null,"abstract":"<p>The reaction of lithium amide LiN(Si(Me)<sub>3</sub>)<sub>2</sub> and ditopic heterocyclic ligand benzo[1,2-<i>d</i>:4,5-<i>d</i>′]bis(thiazole)-2,6(3<i>H</i>,7<i>H</i>)-dithione (H<sub>2</sub>L) in dimethoxyethane (DME) affords the binuclear molecular complex Li<sub>2</sub>L(DME)<sub>4</sub> (<b>I</b>). New compounds [Li<sub>2</sub>L(DMSO)<sub>4</sub>·(DMSO)<sub>2</sub>]<sub><i>n</i></sub> (<b>II</b>) and [Li<sub>2</sub>L(DMSO)<sub>4</sub>·(THF)<sub>2</sub>]<sub><i>n</i></sub> (<b>III</b>) are prepared by the recrystallization of compound <b>I</b> using a DMSO–diethyl ether or DMSO/THF mixture of solvents, respectively. According to the XRD data, these compounds are one-dimensional Coordination polymer (CPs) differed by the arrangement of the bis(thiazole) fragments relative to each other and the Li<sub>2</sub>O<sub>2</sub> fragment in the polymer chain, which affects the luminescence properties. The molecular structures of compounds <b>I</b>–<b>III</b> are determined by XRD (CIF files CCDC nos. 2334192 (<b>I</b>), 2334193 (<b>II</b>), and 2334194 (<b>III</b>)).</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 9","pages":"689 - 696"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1134/S1070328424600414.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790386","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Development of the Cluster Chemistry, Supramolecular Chemistry and Chemistry of Metal-Organic Frameworks by Professor Vladimir P. Fedin and His School","authors":"M. N. Sokolov, D. N. Dybtsev","doi":"10.1134/S1070328424601031","DOIUrl":"10.1134/S1070328424601031","url":null,"abstract":"<p>The article briefly summarizes the main scientific directions contributed to and developed by the outstanding scientist—a leader in the field of coordination chemistry, cluster chemistry, supramolecular chemistry and chemistry of metal-organic coordination polymers, Corresponding Member of the Russian Academy of Sciences Vladimir Petrovich Fedin.</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 9","pages":"613 - 619"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790286","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Slow Magnetization Relaxation in a Bidentate Chelate Ligand–Tb(III)–Fe(II) Trinuclear Compound","authors":"B. Y. Li, H. M. Dong, H. D. Li, S. J. Zhang","doi":"10.1134/S107032842460027X","DOIUrl":"10.1134/S107032842460027X","url":null,"abstract":"<p>A trinuclear [Fe<sub>2</sub>Tb] (for Fe(II) and Tb(III)) cluster, with the formula of [Tb(HFac)<sub>3</sub>(Fe-NO-Butan)] (HFac = hexafluoroacetylacetonate; Fe-NO-Butan = bi(ferrocenylmethyl)-2,3-bi(N-oxide)-2,3-dimethylbutan) based on a nitrogen oxidation bidentate chelate ligand, has been successfully constructed and structurally characterized, which is composed of two diamagnetic ferrocenyl segments and a paramagnetic [Tb(HFac)<sub>3</sub>] unit. Magnetic investigation reveals that [Fe<sub>2</sub>Tb] compound exhibits field-induced slow magnetic relaxation behavior with effective barrier Δ<sub>eff</sub>/<i>k</i><sub>B</sub> ≈ 12.80 K, deriving from isolated anisotropic Tb<sup>3+</sup> ion.</p>","PeriodicalId":759,"journal":{"name":"Russian Journal of Coordination Chemistry","volume":"50 10","pages":"786 - 790"},"PeriodicalIF":1.1,"publicationDate":"2024-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142790421","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}