Crystal structure of a trinuclear complex of zinc(II) with 2,6-Di-tert-butyl-p-quinone 1′-phthalazinylhydrazone

Autor:	A. E. Gol’dberg, V. A. Kogan, Mikhail A. Kiskin, Y.-U. P. Tupolova, Sergey I. Levchenkov, Leonid D. Popov, Igor N. Shcherbakov
Rok vydání:	2014
Předmět:	Diazine chemistry.chemical_classification Stereochemistry Chemistry Hydrazone chemistry.chemical_element Crystal structure Zinc Medicinal chemistry Tautomer Quinone Inorganic Chemistry chemistry.chemical_compound Materials Chemistry Proton NMR Physical and Theoretical Chemistry Phthalazine
Zdroj:	Journal of Structural Chemistry. 55:475-480
ISSN:	1573-8779 0022-4766
DOI:	10.1134/s0022476614030123
Popis:	2,6-Di-tert-butyl-p-quinone 1′-phthalazynylhydrazone (HL) is synthesized; the total energies and geometry of the possible hydrazone tautomeric forms are calculated by quantum chemical methods. The hydrazone phthalazone tautomer is shown to be the most stable, which is well consistent with the 1H NMR spectroscopic data for hydrazone. An X-ray crystallographic analysis is performed of the hydrazone-based Zn(II) trinuclear complex, in which zinc atoms are linked by the diazine bridge of the phthalazine cycle and two pivalate bridges. The geometric properties of the monodeprotonated hydrazone residue in the complex are similar to the calculated data for the phthalazone hydrazone tautomeric form.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::82e94f76c5ce1a256bde1524926d8789 https://doi.org/10.1134/s0022476614030123 Zobrazit plný text záznamu Plný text ve formátu PDF