Heteroleptic Cobalt Complexes with Abnormally Coordinated N-Heterocyclic Carbene

P. A. Petrov; Петров П. А.; S. A. Nikolaevskii; Николаевский С. А.; D. S. Yambulatov; Ямбулатов Д. С.; T. S. Sukhikh; Сухих Т. С.; A. A. Starikova; Старикова А. А.; M. A. Kiskin; Кискин М. А.; M. N. Sokolov; Соколов М. Н.; I. L. Eremenko; Еременко И. Л.

doi:10.31857/S0132344X22600527

Heteroleptic Cobalt Complexes with Abnormally Coordinated N-Heterocyclic Carbene

Authors: Petrov P.A.¹, Nikolaevskii S.A.², Yambulatov D.S.², Sukhikh T.S.¹, Starikova A.A.³, Kiskin M.A.², Sokolov M.N.¹, Eremenko I.L.²
Affiliations:
1. Nikolaev Institute of Inorganic Chemistry, Siberian Branch, Russian Academy of Sciences, Novosibirsk, Russia
2. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Moscow, Russia
3. Institute of Physical and Organic Chemistry, Southern Federal University, Rostov-on-Don, Russia
Issue: Vol 49, No 7 (2023)
Pages: 398-405
Section: Articles
URL: https://rjonco.com/0132-344X/article/view/667494
DOI: https://doi.org/10.31857/S0132344X22600527
EDN: https://elibrary.ru/YJHFWF
ID: 667494

Cite item

Full Text

Open Access
Restricted Access

Access granted
Restricted Access

Subscription Access

Abstract
About the authors
References
Supplementary files
Statistics

Abstract

The reaction of cobalt pivalate [Co(Piv)2]n and in situ generated N‑heterocyclic carbene IPrPh (1,3-bis(2,6-diisopropylphenyl)-2-phenylimidazol-4-ylidene) affords heteroligand complexes [Co2(Piv)4-(IPrPh)2] (I), [Co2(Piv)2.8(OtBu)1.2(IPrPh)2] (II), and [Co3(μ3-O)(Piv)4(IPrPh)2] (III). The structures of complexes II·C6H14 and III are determined by X-ray diffraction (XRD) (CIF files CCDC nos. 2216724 and 2216725, respectively). Exchange spin-spin interactions between the magnetic Со2+ ions in the synthesized compounds are estimated by quantum chemical calculations.

Keywords

cobalt, carboxylates, carbenes, XRD, quantum chemical calculations

References

N-Heterocyclic Carbenes: From Laboratory Curiosities to Efficient Synthetic Tools / Ed. Diez-Gonzalez S. Croydon (UK): The Royal Society of Chemistry, 2016.
Hopkinson M.N., Richter C., Schedler M., Glorius F. // Nature. 2014. V. 510. P. 485.
Wang D., Leng X., Ye S., Deng L. // J. Am. Chem. Soc. 2019. V. 141. P. 7731.
Sinha N., Pfund B., Wegeberg C. et al. // J. Am. Chem. Soc. 2022. V. 144. P. 9859.
Smith J.M., Long J.R. // Inorg. Chem. 2010. V. 49. P. 11223.
Zolnhofer E.M., Käß M., Khusniyarov M.M. et al. // J. Am. Chem. Soc. 2014. V. 136. P. 15072.
Massard A., Braunstein P., Danopoulos A.A. et al. // Organometallics. 2015. V. 34. P. 2429.
Bellan E.V., Poddel’sky A.I., Protasenko N.A. et al. // ChemistrySelect. 2016. V. 1. P. 2988.
Hu X., Castro-Rodriguez I., Meyer K. // J. Am. Chem. Soc. 2004. V. 126. P. 13464.
Gao Y., Li G., Deng L. // J. Am. Chem. Soc. 2018. V. 140. P. 2239.
Tokmic K., Markus C.R., Zhu L., Fout A.R. // J. Am. Chem. Soc. 2016. V. 138. P. 11907.
Wang D., Lai Y., Wang P et al. // J. Am. Chem. Soc. 2021. V. 143. P. 12847.
Mo Z., Xiao J., Gao Y., Deng L. // J. Am. Chem. Soc. 2014. V. 136. P. 17414.
Liu Y., Deng L. // J. Am. Chem. Soc. 2017. V. 139. P. 1798.
Yu R.P., Darmon J.M., Milsmann C. // J. Am. Chem. Soc. 2013. V. 135. P. 13168.
Harris C.F., Bayless M.B., van Leest N.P. // Inorg. Chem. 2017. V. 56. P. 12421.
Deng L., Bill E., Wieghardt K., Holm R.H. // J. Am. Chem. Soc. 2009. V. 131. P. 11213.
Tokmic K., Greer R.B., Zhu L., Fout A.R. // J. Am. Chem. Soc. 2018. V. 140. P. 14844.
Yao X.-N., Du J.-Z., Zhang Y.-Q. et al. // J. Am. Chem. Soc. 2017. V. 139. P. 37.
Ghadwal R.S., Reichmann S.O., Herbst-Irmer R. // Chem. Eur. J. 2015. V. 21. P. 4247.
Rottschäfer D., Glodde T., Neumann B. et al. // Chem. Commun. 2020. V. 56. P. 2027.
Nikolaevskii S.A., Petrov P.A., Sukhikh T.S. et al. // In-org. Chim. Acta. 2020. V. 508. P. 119643.
Yambulatov D.S., Petrov P.A., Nelyubina Y.V. et al. // Mendeleev Commun. 2020. V. 30. P. 293.
Yambulatov D.S., Nikolaevskii S.A., Shmelev M.A. et al. // Mendeleev Commun. 2021. V. 31. P. 624.
Gordon A.J., Ford R.A. The Chemist’s Companion: A Handbook of Practical Data, Techniques, and References. N.Y.: Wiley, 1972.
Petrov P.A., Smolentsev A.I., Bogomyakov A.S., Konchenko S.N. // Polyhedron. 2017. V. 129. P. 60.
Apex3 software suite: Apex3, SADABS-2016/2 and SAINT. Version 2018.7-2. Madiso (WI, USA): Bruker AXS Inc., 2017.
Sheldrick G.M. // Acta Crystallogr. A. 2015. V. 71. P. 3.
Sheldrick G.M. // Acta Crystallogr. C. 2015. V. 71. P. 3.
Dolomanov O.V., Bourhis L.J., Gildea R.J. et al. // J. A-ppl. Crystallogr. 2009. V. 42. P. 339.
Frisch M.J., Trucks G.W., Schlegel H.B. et al. Gaussian 16. Revision C. 01. Wallingford: Gaussian, 2016.
Becke A.D. // J. Chem. Phys. 1992. V. 96. P. 2155.
Grimme S., Ehrlich S., Goerigk L. // J. Comput. Chem. 2011. V. 32. P. 1456.
Chegerev M.G., Piskunov A.V., Tsys K.V. et al. // Eur. J. Inorg. Chem. 2019. V. 2019. P. 875.
Tsys K.V., Chegerev M.G., Fukin G.K. et al. // Mendeleev Commun. 2020. V. 30. P. 205.
Noodleman L. // J. Chem. Phys. 1981. V. 74. P. 5737.
Shoji M., Koizumi K., Kitagawa Y. et al. // Chem. Phys. Lett. 2006. V. 432. P. 343.
Chemcraft. Version 1.8. 2014. http://www.chemcraftprog.com
Ghadwal R.S., Lamm J.-H., Rottschäfer D. et al. // Dalton Trans. 2017. V. 46. P. 7664.