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, MarkoKyne, Sara H.
Gruden, Maja
Rodić, Marko
Jeremić, Dejan
Stanković, Dalibor
Brčeski, Ilija
Article (Published version)
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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, 1241-1248Publisher:
- Springer-Verlag GmbH Austria
Funding / projects:
- Rational design and synthesis of biologically active and coordination compounds and functional materials, relevant for (bio)nanotechnology (RS-MESTD-Basic Research (BR or ON)-172035)
- Structure-properties relationships of natural and synthetic molecules and their metal complexes (RS-MESTD-Basic Research (BR or ON)-172017)
- Magbiovin project (FP7-ERAChairs-Pilot Call-2013, Grant agreement: 621375)
Note:
- Supplementary material: http://cherry.chem.bg.ac.rs/handle/123456789/3317
DOI: 10.1007/s00706-019-02405-7
ISSN: 0026-9247
WoS: 000475674200009
Scopus: 2-s2.0-85068563687
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Institution/Community
Hemijski fakultet / Faculty of ChemistryTY - JOUR AU - Perić, Marko AU - Kyne, Sara H. AU - Gruden, Maja AU - Rodić, Marko AU - Jeremić, Dejan AU - Stanković, Dalibor AU - Brčeski, Ilija PY - 2019 UR - https://cherry.chem.bg.ac.rs/handle/123456789/3316 AB - 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. PB - Springer-Verlag GmbH Austria T2 - Monatshefte fur Chemie T1 - Synthesis, structural and DFT analysis of a binuclear nickel(II) complex with the 1,4-bis[2-[2-(diphenylphosphino)benzylidene]]phthalazinylhydrazone ligand VL - 150 IS - 7 SP - 1241 EP - 1248 DO - 10.1007/s00706-019-02405-7 ER -
@article{ author = "Perić, Marko and Kyne, Sara H. and Gruden, Maja and Rodić, Marko and Jeremić, Dejan and Stanković, Dalibor and Brčeski, Ilija", year = "2019", abstract = "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.", publisher = "Springer-Verlag GmbH Austria", journal = "Monatshefte fur Chemie", title = "Synthesis, structural and DFT analysis of a binuclear nickel(II) complex with the 1,4-bis[2-[2-(diphenylphosphino)benzylidene]]phthalazinylhydrazone ligand", volume = "150", number = "7", pages = "1241-1248", doi = "10.1007/s00706-019-02405-7" }
Perić, M., Kyne, S. H., Gruden, M., Rodić, M., Jeremić, D., Stanković, D.,& Brčeski, I.. (2019). Synthesis, structural and DFT analysis of a binuclear nickel(II) complex with the 1,4-bis[2-[2-(diphenylphosphino)benzylidene]]phthalazinylhydrazone ligand. in Monatshefte fur Chemie Springer-Verlag GmbH Austria., 150(7), 1241-1248. https://doi.org/10.1007/s00706-019-02405-7
Perić M, Kyne SH, Gruden M, Rodić M, Jeremić D, Stanković D, Brčeski I. Synthesis, structural and DFT analysis of a binuclear nickel(II) complex with the 1,4-bis[2-[2-(diphenylphosphino)benzylidene]]phthalazinylhydrazone ligand. in Monatshefte fur Chemie. 2019;150(7):1241-1248. doi:10.1007/s00706-019-02405-7 .
Perić, Marko, Kyne, Sara H., Gruden, Maja, Rodić, Marko, Jeremić, Dejan, Stanković, Dalibor, Brčeski, Ilija, "Synthesis, structural and DFT analysis of a binuclear nickel(II) complex with the 1,4-bis[2-[2-(diphenylphosphino)benzylidene]]phthalazinylhydrazone ligand" in Monatshefte fur Chemie, 150, no. 7 (2019):1241-1248, https://doi.org/10.1007/s00706-019-02405-7 . .