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  • Tris[1-phenylisoquinoline-C2,N]iridium(III), purified by sublimation

  • Tris[1-phenylisoquinoline-C2,N]iridium(III), purified by sublimation

    Catalog Number
    ACM435293939-3
    CAS Number
    435293-93-9
    Product Name
    Tris[1-phenylisoquinoline-C2,N]iridium(III), purified by sublimation
    Structure
    Category
    Sublimed Materials
    IUPAC Name
    iridium(3+);1-phenylisoquinoline
    Molecular Weight
    805g/mol
    Molecular Formula
    C45H30IrN3
    Canonical SMILES
    C1=CC=C([C-]=C1)C2=NC=CC3=CC=CC=C32.C1=CC=C([C-]=C1)C2=NC=CC3=CC=CC=C32.C1=CC=C([C-]=C1)C2=NC=CC3=CC=CC=C32.[Ir+3]
    InChI
    InChI=1S/3C15H10N.Ir/c3*1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15;/h3*1-7,9-11H;/q3*-1;+3
    InChI Key
    NDBCGHNTWCYIIU-UHFFFAOYSA-N
    Application
    Tris[1-phenylisoquinoline-C2,N]iridium(III), purified by sublimation, serves as a deep red phosphorescent dopant material with significant utility in optoelectronic applications. This compound, Ir(piq)3, is renowned for its high electron affinity, attributed to the enhanced π-electronic conjugation in its isoquinoline ring. This structure results in a reduced energy gap by significantly lowering the energy of the lowest unoccupied molecular orbital (LUMO). In its family of isoquinoline iridium complexes, Ir(piq)3 is frequently studied alongside Ir(piq)2acac because its 'piq' ligand unit effectively suppresses triplet-triplet annihilation, leading to shorter phosphorescent lifetimes.
    Complexity
    1180
    Covalently-Bonded Unit Count
    4
    Exact Mass
    805.2069g/mol
    Formal Charge
    0
    Heavy Atom Count
    49
    Monoisotopic Mass
    805.2069g/mol
    Rotatable Bond Count
    3
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