Structural speciation in chemical reactivity profiling of binary-ternary systems of Ni(II) with iminodialcohol and aromatic chelators

Matsia, Sevasti; Kaoulla, A.; Menelaou, Melita; Hatzidimitriou, Antonios G.; Papadopoulos, Theodoros A.; Reimann, Maximilian Kai; Pöttgen, Rainer; Salifoglou, Athanasios

doi:10.1016/j.poly.2021.115577

Cited by 3 publications

(1 citation statement)

References 49 publications

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“…Selected bond lengths and angles are gathered in Table S1 (see supporting information). The Ni-N(phen) and Ni-O(NO3) bond distances are typical values of related Ni-phen [24][25][26] and Ni-N(NO3) [27] complexes.…”

Section: Molecular Structure Of Crystalsmentioning

confidence: 99%

Structures, Characterization and DFT Studies of Four Novel Nickel Phenanthroline Complexes

et al. 2023

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Four Ni–phen complexes were prepared and characterized by FTIR and thermal analysis. The X-ray structure determination shows that the geometry around NiII ions in complexes 1, [Ni(phen)2(H2O)(ONO2)](NO3); 2, [Ni(phen)2(H2O)Cl]Cl; 3, [Ni(phen)(CH3CN)(ONO2)(O2NO)] and 4, [Ni(phen)3](NO3)2.H2O.C2H5OH is considerably distorted octahedral. The coordination core geometries in 1, 2, 3 and 4 are NiN4O2, NiN4OCl, NiN3O3 and NiN6, respectively. The crystal packing and crystal supramolecularity analysis of the complexes reveal the importance of aryl∙∙∙aryl interactions, and both offset face-to-face (OFF) and edge-to-face (EF) motifs are dominant. Hydrogen bonding interactions in these structures reinforce aryl∙∙∙aryl interactions. FTIR proved the coordination of M-N and M-Cl as well as the presence of nitro groups in the complexes, while thermal analysis revealed that the loss of water, chloro and nitro groups occurred before the degradation of phenanthroline ligand in the complexes. DFT study indicates that a strong correlation exists among theoretical and experimentally determined geometric parameters with distorted octahedral geometry. The charge density in HOMO is localized on the metal halogen bond and nitrate group (NO3−), whereas the LUMO cloud density is mainly distributed on the phen ring, which indicates the electroactive nature of the ring.

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Section: Molecular Structure Of Crystalsmentioning

confidence: 99%

Structures, Characterization and DFT Studies of Four Novel Nickel Phenanthroline Complexes

et al. 2023

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Ligand Metathesis in Nickel(II) Complexation with closo-Decaborate Anion

et al. 2023

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Ligand Metathesis in Nickel(II) Complexation with closo-Decaborate Anion

Avdeeva,

Kubasov,

Nikiforova

et al. 2023

Koordinacionnaâ himiâ

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Nickel(II) complexation with the closo-decaborate anion in water and acetonitrile is studied. Complexes [Ni(solv)6][B10H10] (solv = H2O (I) or CH3CN (II)) are isolated. The complexes are characterized by elemental analysis and IR spectroscopy. Complex [Ni(CH3CN)5(H2O)]0.75[Ni(CH3CN)4(H2O)2]0.25[B10H10]·0.5H2O (III) is isolated from an acetonitrile–water system. The structure of complex III is solved by X-ray diffraction (XRD) (CIF file CCDС no. 2224702). A mechanism of ligand metathesis in the complexation of nickel(II) is proposed.

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Structural speciation in chemical reactivity profiling of binary-ternary systems of Ni(II) with iminodialcohol and aromatic chelators

Cited by 3 publications

References 49 publications

Structures, Characterization and DFT Studies of Four Novel Nickel Phenanthroline Complexes

Structures, Characterization and DFT Studies of Four Novel Nickel Phenanthroline Complexes

Ligand Metathesis in Nickel(II) Complexation with closo-Decaborate Anion

Ligand Metathesis in Nickel(II) Complexation with closo-Decaborate Anion

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