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Computational search for redox isomerism in Ge and Sn bis-chelates with α-diimine ligands

Maxim Gennad'evich Chegerev 1
Maxim Gennad'evich Chegerev
, 
Alena Andreevna Starikova 1
Alena Andreevna Starikova
, 
Andrey Georgievich Starikov 1
Andrey Georgievich Starikov
, 
Vladimir Isaakovich Minkin 1
Vladimir Isaakovich Minkin
10.1016/j.mencom.2022.01.015
Published 2022-01-03
Communication , Volume 32, Issue 1, 49-51
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Chegerev M. G. et al. Computational search for redox isomerism in Ge and Sn bis-chelates with α-diimine ligands // Mendeleev Communications. 2022. Vol. 32. No. 1. pp. 49-51.
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Chegerev M. G., Starikova A. A., Starikov A. G., Minkin V. I. Computational search for redox isomerism in Ge and Sn bis-chelates with α-diimine ligands // Mendeleev Communications. 2022. Vol. 32. No. 1. pp. 49-51.
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TY - JOUR
DO - 10.1016/j.mencom.2022.01.015
UR - https://mendcomm.colab.ws/publications/10.1016/j.mencom.2022.01.015
TI - Computational search for redox isomerism in Ge and Sn bis-chelates with α-diimine ligands
T2 - Mendeleev Communications
AU - Chegerev, Maxim Gennad'evich
AU - Starikova, Alena Andreevna
AU - Starikov, Andrey Georgievich
AU - Minkin, Vladimir Isaakovich
PY - 2022
DA - 2022/01/03
PB - Mendeleev Communications
SP - 49-51
IS - 1
VL - 32
ER -
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@article{2022_Chegerev,
author = {Maxim Gennad'evich Chegerev and Alena Andreevna Starikova and Andrey Georgievich Starikov and Vladimir Isaakovich Minkin},
title = {Computational search for redox isomerism in Ge and Sn bis-chelates with α-diimine ligands},
journal = {Mendeleev Communications},
year = {2022},
volume = {32},
publisher = {Mendeleev Communications},
month = {Jan},
url = {https://mendcomm.colab.ws/publications/10.1016/j.mencom.2022.01.015},
number = {1},
pages = {49--51},
doi = {10.1016/j.mencom.2022.01.015}
}
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Chegerev, Maxim Gennad'evich, et al. “Computational search for redox isomerism in Ge and Sn bis-chelates with α-diimine ligands.” Mendeleev Communications, vol. 32, no. 1, Jan. 2022, pp. 49-51. https://mendcomm.colab.ws/publications/10.1016/j.mencom.2022.01.015.

Keywords

Bis-chelates
DFT calculations
diimines
group 14 elements
Valence tautomerism

Abstract

The first examples of germanium and tin complexes with α-diimine ligands undergoing reversible redox isomeric (valence tautomeric) rearrangements were demonstrated based on the computational modeling of their dynamic behavior using DFT at the B3LYP/Def2TZVP level.

References

2.
An EPR investigation of the thermodynamics and kinetics of a reversible intramolecular metal-ligand electron transfer in rhodium complexes
Abakumov G.A., Razuvaev G.A., Nevodchikov V.I., Cherkasov V.K.
Journal of Organometallic Chemistry, 1988
3.
The same but different
Bally T.
Nature Chemistry, 2010
4.
Valence Tautomerism: New Challenges for Electroactive Ligands
Evangelio E., Ruiz‐Molina D.
European Journal of Inorganic Chemistry, 2005
7.
Control of Magnetic Properties through External Stimuli
Sato O., Tao J., Zhang Y.
Angewandte Chemie - International Edition, 2007
8.
Cobalt-Dioxolene Redox Isomers: Potential Spintronic Devices
Dei A., Sorace L.
Applied Magnetic Resonance, 2010
10.
10.1016/j.mencom.2022.01.015_b0050
Shultz
Magnetism: Molecules to Materials II: Molecule-Based Materials, 2001
11.
Starikova A.A., Minkin V.I., Starikov A.G.
Mendeleev Communications, 2014
13.
Tin(IV) and lead(IV) complexes with a tetradentate redox-active ligand.
Piskunov A.V., Trofimova O.Y., Fukin G.K., Ketkov S.Y., Smolyaninov I.V., Cherkasov V.K.
Dalton Transactions, 2012
14.
Digallane with Redox-Active Diimine Ligand: Dualism of Electron-Transfer Reactions
Fedushkin I.L., Skatova A.A., Dodonov V.A., Chudakova V.A., Bazyakina N.L., Piskunov A.V., Demeshko S.V., Fukin G.K.
Inorganic Chemistry, 2014
15.
Structures and Magnetic Properties of Group 13 Metal Tris‐O‐benzosemiquinonato Complexes
Piskunov A.V., Meshcheryakova I.N., Maleeva A.V., Bogomyakov A.S., Fukin G.K., Cherkasov V.K., Abakumov G.A.
European Journal of Inorganic Chemistry, 2014
17.
Tin(IV) and Antimony(V) Complexes Bearing Catecholate Ligands Connected to Ferrocene – Syntheses, Molecular Structures, and Electrochemical Properties
Baryshnikova S.V., Bellan E.V., Poddel'sky A.I., Arsenyev M.V., Smolyaninov I.V., Fukin G.K., Piskunov A.V., Berberova N.T., Cherkasov V.K., Abakumov G.A.
European Journal of Inorganic Chemistry, 2016
18.
Compounds of potassium and tin(II) with diiminopyridine ligands: EPR spectroscopy and theoretical study
Chegerev M.G., Piskunov A.V., Starikova A.A.
Russian Journal of General Chemistry, 2017
19.
Chemistry of Complexes of Group 14 Elements Based on Redox-Active Ligands of the o-Iminoquinone Type
Chegerev M.G., Piskunov A.V.
Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya, 2018
20.
Tsys K.V., Chegerev M.G., Fukin G.K., Piskunov A.V.
Mendeleev Communications, 2018
21.
Halogen-free GeO2 conversion: electrochemical reduction vs. complexation in (DTBC)2Ge[Py(CN)n] (n = 0…2) complexes
Nikolaevskaya E.N., Saverina E.A., Starikova A.A., Farhati A., Kiskin M.A., Syroeshkin M.A., Egorov M.P., Jouikov V.V.
Dalton Transactions, 2018
23.
Chemistry of s-, p- and f-block metal complexes with ene-diamido ligands
Bai Y., Chen W., Li J., Cui C.
Coordination Chemistry Reviews, 2019
24.
Features of Magnetic Behavior in the Row of Pentacoordinated Bis‐ o ‐Iminobenzosemiquinonato Metal (Al, Ga, In) Complexes
Ershova I.V., Bogomyakov A.S., Fukin G.K., Piskunov A.V.
European Journal of Inorganic Chemistry, 2019
25.
Complexes of Group III Metals based on o-Iminoquinone Ligands
Ershova I.V., Piskunov A.V.
Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya, 2020
26.
Moskalev M.V., Razborov D.A., Bazanov A.A., Sokolov V.G., Koptseva T.S., Baranov E.V., Fedushkin I.L.
Mendeleev Communications, 2020
27.
Tsys K.V., Chegerev M.G., Fukin G.K., Starikov A.G., Piskunov A.V.
Mendeleev Communications, 2020
28.
Addition of alkynes to a gallium bis-amido complex: imitation of transition-metal-based catalytic systems.
Fedushkin I.L., Nikipelov A.S., Morozov A.G., Skatova A.A., Cherkasov A.V., Abakumov G.A.
Chemistry - A European Journal, 2011
30.
Dialane with a redox-active bis-amido ligand: unique reactivity towards alkynes.
Fedushkin I.L., Moskalev M.V., Lukoyanov A.N., Tishkina A.N., Baranov E.V., Abakumov G.A.
Chemistry - A European Journal, 2012
31.
The reactivity of o-amidophenolate indium(iii) complexes towards different oxidants
Piskunov A.V., Meshcheryakova I.N., Ershova I.V., Bogomyakov A.S., Cherkasov A.V., Fukin G.K.
RSC Advances, 2014
32.
Redox-Active Ligand-Assisted Two-Electron Oxidative Addition to Gallium(II).
Fedushkin I.L., Dodonov V.A., Skatova A.A., Sokolov V.G., Piskunov A.V., Fukin G.K.
Chemistry - A European Journal, 2018
33.
Low valent Al(ii)–Al(ii) catalysts as highly active ε-caprolactone polymerization catalysts: indication of metal cooperativity through DFT studies
Kazarina O.V., Gourlaouen C., Karmazin L., Morozov A.G., Fedushkin I.L., Dagorne S.
Dalton Transactions, 2018
34.
O,N-Heterocyclic germylenes as efficient catalysts for hydroboration and cyanosilylation of benzaldehyde
Arsenyeva K.V., Pashanova K.I., Trofimova O.Y., Ershova I.V., Chegerev M.G., Starikova A.A., Cherkasov A.V., Syroeshkin M.A., Kozmenkova A.Y., Piskunov A.V.
New Journal of Chemistry, 2021
35.
The reactivity of N-heterocyclic germylenes and stannylenes based on 9,10-phenanthrendiimines towards metal carbonyls and sulfur
Kazakov G.G., Druzhkov N.O., Baranov E.V., Piskunov A.V., Cherkasov V.K.
Journal of Organometallic Chemistry, 2021
36.
Valence Tautomerism in Main‐Group Complexes? Computational Modeling of Si, Ge, Sn, and Pb Bischelates with o ‐Iminoquinone Ligands
Chegerev M.G., Starikova A.A., Piskunov A.V., Cherkasov V.K.
European Journal of Inorganic Chemistry, 2015
37.
Redox Isomerism in Main-Group Chemistry: Tin Complex with o-Iminoquinone Ligands
Chegerev M.G., Piskunov A.V., Starikova A.A., Kubrin S.P., Fukin G.K., Cherkasov V.K., Abakumov G.A.
European Journal of Inorganic Chemistry, 2018
38.
10.1016/j.mencom.2022.01.015_b0190
Frisch
Gaussian 16, Revision A.03, 2016
40.
A general algorithm for calculation of Heisenberg exchange integrals J in multispin systems
Shoji M., Koizumi K., Kitagawa Y., Kawakami T., Yamanaka S., Okumura M., Yamaguchi K.
Chemical Physics Letters, 2006
43.
Chemistry of diazadiene type ligands with extra coordination groups. Prospects of reactivity
Nikolaevskaya E.N., Druzhkov N.O., Syroeshkin M.A., Egorov M.P.
Coordination Chemistry Reviews, 2020