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- Publisher
- Springer Journals
- Copyright
- Copyright © Pleiades Publishing, Inc. 2022. ISSN 1063-7745, Crystallography Reports, 2022, Vol. 67, No. 4, pp. 575–580. © Pleiades Publishing, Inc., 2022. Russian Text © The Author(s), 2022, published in Kristallografiya, 2022, Vol. 67, No. 4, pp. 617–622.
- ISSN
- 1063-7745
- eISSN
- 1562-689X
- DOI
- 10.1134/s1063774522040150
- Publisher site
- See Article on Publisher Site
Abstract
The crystal structure of the Cu(II) binuclear complex with 5-phenyltetrazole and 4,4'-dimethyl-2,2'-bipyridine (dmbipy), [Cu2(dmbipy)2L4], has been determined. The complex crystallizes in a monoclinic space group P21/c. The distorted square-pyramidal environment of Cu(II) atoms is formed by five nitrogen atoms belonging to three 5-phenyltetrazolate anions and one dmbipy molecule. Due to the presence of the intermolecular interactions π···π and C–H···π, the binuclear molecules combine into a supramolecular layered structure. The bonding energy has been calculated in terms of the density functional theory for two models of the [Cu2(dmbipy)2L4] complex with various coordination modes of the bridging 5-phenyltetrazole.
Journal
Crystallography Reports – Springer Journals
Published: Aug 1, 2022