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1.
Chem Commun (Camb) ; 58(38): 5733-5736, 2022 May 10.
Article in English | MEDLINE | ID: mdl-35438119

ABSTRACT

Bis-terdentate (N^N^N) ligands coordinated to Cr(III) yield complexes that display near-IR emission under aerated solvent conditions at room temperature.


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Ligands
2.
Inorg Chem ; 60(20): 15467-15484, 2021 Oct 18.
Article in English | MEDLINE | ID: mdl-34605234

ABSTRACT

A series of ligands have been synthesized based upon a polysubstituted 2-phenylquinoxaline core structure. These ligands introduce different combinations of fluorine and methyl substituents on both the phenyl and quinoxaline constituent rings. The resultant investigation of these species as cyclometalating agents for Ir(III) gave cationic complexes of the form [Ir(C^N)2(bipy)]PF6 (where C^N = cyclometalating ligand; bipy = 2,2'-bipyridine). X-ray crystallographic studies were conducted on four complexes and each revealed the expected distorted octahedral geometry based upon a cis-C,C and trans-N,N ligand arrangement at Ir(III). Supporting computational studies predict that each of the complexes share the same general descriptions for the frontier orbitals. TD-DFT calculations suggest MLCT contributions to the lowest energy absorption and a likely MLCT/ILCT/LLCT nature to the emitting state. Experimentally, the complexes display tunable luminescence across the yellow-orange-red part of the visible spectrum (λem = 579-655 nm).

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