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

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

    Catalog Number
    ACM435293939-4
    CAS Number
    435293-93-9
    Product Name
    Tris[1-phenylisoquinoline-C2,N]iridium(III)
    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), or Ir(piq)3, is a deep red phosphorescent dopant material utilized in optoelectronic applications. Its purpose is to leverage the high electron affinities characteristic of quinoline and isoquinoline compounds, which are highly valued for their electronic properties. By incorporating isoquinoline, which has enhanced π-electronic conjugation, this compound effectively lowers the energy of the lowest unoccupied molecular orbital (LUMO), consequently reducing the energy gap. This feature, alongside the unique 'piq' units, helps mitigate triplet-triplet annihilation, resulting in shorter phosphorescent lifetimes. Ir(piq)3, along with Ir(piq)2acac, are leading compounds studied within the family of isoquinoline iridium complexes for their promising role in enhancing the efficiency of optoelectronic devices.
    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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