Hybrid Quinoline Telluroether Ligand Derived Copper and Silver Complexes: Synthesis, Structural and Electronic Properties DOI
Saravanan Raju, Harkesh B. Singh, Sangit Kumar

et al.

European Journal of Inorganic Chemistry, Journal Year: 2022, Volume and Issue: 2022(28)

Published: Aug. 8, 2022

Abstract The tetradentate organotelluroether (C 9 H 6 NTe) 2 CH ligand has been synthesized and its coordination behaviour with a stoichiometric amount of copper(II) silver(I) perchlorate triflate salts experimentally investigated. isolated metal complexes are characterized by multinuclear ( 1 H, 13 C, 125 Te) NMR spectroscopy, single crystal X‐ray diffraction, DFT calculations. analysis revealed the formation self‐assembled bimetallic molecular formula 2[M(C ] + X − [M =Cu, Ag; =ClO 4 , CF 3 SO ]. Further, it noticed that ions act as bridging unit to form cationic 8‐membered metallamacrocycles in chair conformation. atoms molecule (AIM) non‐covalent interactions (NCI) display weak intramolecular Te⋅⋅⋅Te interaction. Natural bond orbital (NBO) calculations suggest tellurium rich electron donating ability toward than quinoline nitrogen complexes.

Language: Английский

Halogen bonds, chalcogen bonds, pnictogen bonds, tetrel bonds and other σ-hole interactions: a snapshot of current progress DOI Creative Commons
Lee Brammer, Anssi Peuronen, Thomas M. Roseveare

et al.

Acta Crystallographica Section C Structural Chemistry, Journal Year: 2023, Volume and Issue: 79(6), P. 204 - 216

Published: May 15, 2023

We report here on the status of research halogen bonds and other σ-hole interactions involving p -block elements in Lewis acidic roles, such as chalcogen bonds, pnictogen tetrel bonds. A brief overview available literature this area is provided via a survey many review articles that address field. Our focus has been to collect together most published since 2013 provide an easy entry into extensive area. snapshot current by introduction virtual special issue compiled journal, comprising 11 entitled ` Halogen, chalcogen, bonds: structural chemistry beyond .'

Language: Английский

Citations

46

Carbon-based Biradicals: Structural and Magnetic Switching DOI
Yusuke Ishigaki, Takashi Harimoto, Takuya Shimajiri

et al.

Chemical Reviews, Journal Year: 2023, Volume and Issue: 123(24), P. 13952 - 13965

Published: Nov. 10, 2023

Sterically hindered C═C double bonds often deform into a bent or twisted geometry. Thus, many overcrowded ethylenes anthraquinodimethanes can adopt multiple conformations, such as folded form form, which are interconvertible under the application of external stimuli. A perpendicular with biradical character also be adopted when designed to incorporate stable carbon-based radical unit, is involved in stimuli-responsive magnetic switching accompanied by structural change. This review focuses on recent advances development strained π-electron systems and reveals factors that affect mutual interconversion behavior. The energy barrier for conformational isomers affected tricyclic skeleton bulky substituents bonds, whereas relative stability increases additional insertion 9,10-anthrylene units bonds.

Language: Английский

Citations

26

A new look at the chalcogen bond: π-hole-based chalcogen (Se, Te) bonding which does not include a σ-hole interaction DOI
Eugene A. Katlenok, Maxim L. Kuznetsov, Nikolay A. Semenov

et al.

Inorganic Chemistry Frontiers, Journal Year: 2023, Volume and Issue: 10(10), P. 3065 - 3081

Published: Jan. 1, 2023

Chalcogen bonding which does not include σ-hole interaction.

Language: Английский

Citations

17

Chalcogen Bond versus Halogen Bond: Changing Contributions in Determining the Crystal Packing of Dihalobenzochalcogenadiazoles DOI
Yusuke Ishigaki,

Kai Shimomura,

Kota Asai

et al.

Bulletin of the Chemical Society of Japan, Journal Year: 2022, Volume and Issue: 95(3), P. 522 - 531

Published: Feb. 14, 2022

Abstract In the crystals of 4,7-dihalobenzo[c][1,2,5]chalcogenadiazoles, molecules are connected by two competing secondary bonding interactions: chalcogen bond (ChB) and halogen (HaB). Because strengths ChB HaB change according to kind (E: S, Se, Te) (X: Cl, Br, I), their relative contributions in determining crystal packing can also change. Six newly determined structures as well 3 previously reported be categorized into groups: ChB-dominant HaB-dominant structures. which X = I is strong enough dictate compounds with E S but not where Te, whereas Cl or Br has little effect on molecular networks crystals. The observed changing may useful for designing new supramolecular synthons engineering.

Language: Английский

Citations

17

Substituent Effect on Chalcogen Bonding in 5-Substituted Benzo[c][1,2,5]selenadiazoles and Their Copper(II) Complexes: Experimental and Theoretical Study DOI
Vusala A. Aliyeva, Atash V. Gurbanov, M. Fátima C. Guedes da Silva

et al.

Crystal Growth & Design, Journal Year: 2023, Volume and Issue: 24(2), P. 781 - 791

Published: Dec. 27, 2023

In parallel to the nature of chalcogen atom (Ch) and nucleophile (Nu), strength directionality bonding (ChB) are also dependent on electron donor or acceptor character functional group (R) at ∠R–Ch···Nu. Although Hammett's para-substituent constant (σp) can be used for quantitative description substituent effects, herein, we found that due participation substituents in various types intermolecular interactions, there is no linear relationship between σp R (X = −CH3, −H, −F, −Cl, −Br, −NO2) experimental Se···N distance ∠N–Se···N angle 5-substituted benzo[c][1,2,5]selenadiazoles their copper(II) complexes. Such a not observed theoretically, which rationalized by taking into consideration formation intramolecular hydrogen bonds Cu The have been analyzed using quantum theory "atoms molecules" combined with noncovalent interaction plot energy decomposition analysis.

Language: Английский

Citations

10

Recent advances in the synthesis and reactions of tellurium heterocycles DOI

Kokila Sakthivel,

R. Gana,

Fateh V. Singh

et al.

Advances in heterocyclic chemistry, Journal Year: 2025, Volume and Issue: unknown

Published: Jan. 1, 2025

Language: Английский

Citations

0

Synthesis and structural studies of 1-naphthyl and mesityl ligand bearing organotellurium(II and IV) derivatives DOI
Amit Kumar Tripathi, Puspendra Singh,

Anamika Anamika

et al.

Polyhedron, Journal Year: 2025, Volume and Issue: unknown, P. 117463 - 117463

Published: Feb. 1, 2025

Language: Английский

Citations

0

Tuning Molecular Electron Affinities against Atomic Electronegativities by Spatial Expansion of a π‐System DOI
Elena A. Chulanova, Ekaterina A. Radiush, Nikolay A. Semenov

et al.

ChemPhysChem, Journal Year: 2023, Volume and Issue: 24(9)

Published: Jan. 20, 2023

Abstract 2,1,3‐Benzochalcogenadiazoles C 6 R 4 N 2 E ( / ; E=S, Se, Te; R=H, F, Cl, Br, I) and H R’ R=Br, are 10π‐electron hetarenes. By CV/EPR measurements, DFT calculations, QTAIM ELI‐D analyses, it is shown that their molecular electron affinities (EAs) increase with decreasing Allen electronegativities of the non‐hydrogen (except Cl) atoms. calculations for +e⋅ − →[E/R]⋅ capture reveal negative ΔG values numerically increasing atomic numbers atoms; positive ΔS has a minor influence. It suggested EA caused by more effective charge/spin delocalization in radical anions heavier derivatives due to contributions from diffuse (a real‐space expanded) p‐AOs this counterintuitive effect might be general character.

Language: Английский

Citations

8

Te⋯I secondary-bonding interactions in crystals containing tellurium(ii), tellurium(iv) and iodide atoms: supramolecular aggregation patterns, nature of the non-covalent interactions and energy considerations DOI
Rosa M. Gomila, Antonio Frontera, Edward R. T. Tiekink

et al.

CrystEngComm, Journal Year: 2024, Volume and Issue: 26(21), P. 2784 - 2795

Published: Jan. 1, 2024

The importance of σ-hole bonding is emphasised in a series mixed tellurium( ii )/tellurium( iv )/iodide crystals.

Language: Английский

Citations

3

Exploring the Effects of Se Basicity on a Te···Se Interaction Supported by a Rigid Indazolium Backbone DOI Creative Commons

Logan T. Maltz,

François P. Gabbaı̈

Organometallics, Journal Year: 2024, Volume and Issue: 43(11), P. 1246 - 1255

Published: May 29, 2024

With an interest in chalcogen bonding, we use a rigid indazolium backbone to install formally zero-valent Se center next divalent Te center, allowing us investigate the effects of oxidation on observed Te···Se interaction. Through spectroscopic and computational comparison Se(0) species with its Se(II) counterpart their monochalcogen analogues, experimentally computationally effect modulating basicity resulting Comparison well-studied naphthalene acenaphthene variants indicates that increased allows for comparably strong interaction despite longer peri distances larger splay angle. Finally, our study illuminates potential non-innocence cationic organic substituents chalcogen-bonding catalysis transfer hydrogenation quinolines.

Language: Английский

Citations

3