6-[2,4-bis(fluoranyl)phenyl]-3H-pyridin-3-ide; chloranyliridium(2+)

Systemtic Name: 6-[2,4-bis(fluoranyl)phenyl]-3H-pyridin-3-ide; chloranyliridium(2+) Openeye Name: chloroiridium(2+); 6-(2,4-difluorophenyl)-3H-pyridin-3-ide CAS Name: chloroiridium(2+); 6-(2,4-difluorophenyl)-3H-pyridin-3-ide IUPAC Name: chloroiridium(2+); 6-(2,4-difluorophenyl)-3H-pyridin-3-ide Traditional Name: chloroiridium(2+); 6-(2,4-difluorophenyl)-3H-pyridin-3-ide Formula: C44H24Cl2F8Ir2N4 MolecularWeight: 1216.015386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.Cl[Ir+2].Cl[Ir+2]

Isomeric SMILES

C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.C1=CC(=C(C=C1F)F)C2=CC=[C-]C=N2.Cl[Ir+2].Cl[Ir+2]

InChI

InChI=1S/4C11H6F2N.2ClH.2Ir/c4*12-8-4-5-9(10(13)7-8)11-3-1-2-6-14-11;;;;/h4*1,3-7H;2*1H;;/q4*-1;;;2*+3/p-2