2-[2,4-bis(fluoranyl)benzene-6-id-1-yl]-4-methoxy-pyridine; iridium; 2-(5-phenyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine

Systemtic Name: 2-[2,4-bis(fluoranyl)benzene-6-id-1-yl]-4-methoxy-pyridine; iridium; 2-(5-phenyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine Openeye Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-pyridine; iridium; 2-(5-phenyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine CAS Name: 2-(2,4-difluoro-1-benzene-6-idyl)-4-methoxypyridine; iridium; 2-(5-phenyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine IUPAC Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxypyridine; iridium; 2-(5-phenyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine Traditional Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methoxy-pyridine; iridium; 2-(5-phenyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine Formula: C25H17F2IrN5O-2 MolecularWeight: 633.649186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC=C1)C2=C(C=C(C=[C-]2)F)F.C1=CC=C(C=C1)C2=N[N-]C(=N2)C3=CC=CC=N3.[Ir]

Isomeric SMILES

COC1=CC(=NC=C1)C2=C(C=C(C=[C-]2)F)F.C1=CC=C(C=C1)C2=N[N-]C(=N2)C3=CC=CC=N3.[Ir]

InChI

InChI=1S/C13H9N4.C12H8F2NO.Ir/c1-2-6-10(7-3-1)12-15-13(17-16-12)11-8-4-5-9-14-11;1-16-9-4-5-15-12(7-9)10-3-2-8(13)6-11(10)14;/h1-9H;2,4-7H,1H3;/q2*-1;