Effect of linear and non-linear pseudohalides on the structural and magnetic properties of Co(II) hexacoordinate single-molecule magnets
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989592%3A15310%2F18%3A73591067" target="_blank" >RIV/61989592:15310/18:73591067 - isvavai.cz</a>
Result on the web
<a href="https://pubs.rsc.org/en/content/articlepdf/2018/dt/c7dt04256f" target="_blank" >https://pubs.rsc.org/en/content/articlepdf/2018/dt/c7dt04256f</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1039/c7dt04256f" target="_blank" >10.1039/c7dt04256f</a>
Alternative languages
Result language
angličtina
Original language name
Effect of linear and non-linear pseudohalides on the structural and magnetic properties of Co(II) hexacoordinate single-molecule magnets
Original language description
A series of mononuclear hexacoordinate Co(II) complexes with the 4-amino-3,5-bis(2-pyridyl)-1,2,4-triazole (abpt) ligand and various linear and non-linear pseudohalides, such as NCSe (selenocyanate), N{C(CN)(2)}(2) (1,1,3,3-tetracyano-2-azapropenide, tcap), NO2C(CN)(2) (nitrodicyanomethanide, nodcm), C(CN) {C(CN)(2)}(2) (1,1,2,3,3-pentacyanopropenide, pcp), NO2NCN (nitrocyanamide, nca), and ONC(CN)(2) (nitrosodicyanomethanide, ndcm), was prepared. X-ray analyses revealed the formation of the complexes with the general compositions [Co(abpt)(2)(solv)(2)] X-2 (solv = H2O and X = tcap (1), solv = H2O and X = nodcm (2), solv = CH3OH and X = pcp (3)) or [Co(abpt)(2)(X)(2)] (X = nca (4), X = NCSe (5), X = ndcm (6)). The impact of axial co-ligands (solv or X) on the magnetic properties was investigated experimentally by measuring temperature-and field-dependent static (DC) and dynamic magnetic (AC) data as well as theoretically using the CASSCF/NEVPT2, AILFT, and AOM methods. Large magnetic anisotropy was found for all complexes 1-6 and was treated either by the spin Hamiltonian or with the Hamiltonian including the orbital angular momentum. Furthermore, the AC susceptibility measurements confirmed the slow relaxation of the magnetization in a non-zero static magnetic field, thus these complexes can be classified as field-induced single-molecule magnets with an estimated energy barrier U-eff up to 100 K.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
10402 - Inorganic and nuclear chemistry
Result continuities
Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)
Others
Publication year
2018
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
DALTON TRANSACTIONS
ISSN
1477-9226
e-ISSN
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Volume of the periodical
47
Issue of the periodical within the volume
5
Country of publishing house
GB - UNITED KINGDOM
Number of pages
15
Pages from-to
1498-1512
UT code for WoS article
000423760500018
EID of the result in the Scopus database
2-s2.0-85041346926