Synthesis, structural and DFT analysis of a binuclear nickel(II) complex with the 1,4-bis[2-[2-(diphenylphosphino)benzylidene]]phthalazinylhydrazone ligand
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2019
Authors
Perić, Marko R.
Kyne, Sara H.
Gruden, Maja
Rodić, Marko V.
Jeremić, Dejan
Stanković, Dalibor M.
Brčeski, Ilija
Article (Published version)
, © 2019, Springer-Verlag GmbH Austria, part of Springer Nature
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Show full item recordAbstract
In this work we present the synthesis, and experimental and theoretical analysis of a binuclear nickel(II) complex coordinated to a new phthalazine dihydrazone-based ligand. Single-crystal X-ray diffraction analysis of the metal complex shows that the coordination geometry around each nickel(II) atom is distorted octahedral. DFT calculations predict that the magnetic exchange coupling constant of the binuclear nickel(II) complex is predominantly anti-ferromagnetic.
Keywords:
Binuclear complex / Density functional theory / Magnetic properties / X-ray structure determinationSource:
Monatshefte fur Chemie, 2019, 150, 7, 1241-1248Projects:
- Rational design and synthesis of biologically active and coordination compounds and functional materials, relevant for (bio)nanotechnology (RS-172035)
- Structure-properties relationships of natural and synthetic molecules and their metal complexes (RS-172017)
- Strengthening of the MagBioVin Research and Innovation Team for Development of Novel Approaches for Tumour Therapy based on Nanostructured Materials (EU-621375)
Note:
- Supplementary material: http://cherry.chem.bg.ac.rs/handle/123456789/3317
DOI: 10.1007/s00706-019-02405-7
ISSN: 0026-9247