2-[2,4-bis(fluoranyl)benzene-6-id-1-yl]-4-methyl-pyridine; iridium; 2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 2-[2,4-bis(fluoranyl)benzene-6-id-1-yl]-4-methyl-pyridine; iridium; 2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]pyridine Openeye Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methyl-pyridine; iridium; 2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]pyridine CAS Name: 2-(2,4-difluoro-1-benzene-6-idyl)-4-methylpyridine; iridium; 2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]pyridine IUPAC Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methylpyridine; iridium; 2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]pyridine Traditional Name: 2-(2,4-difluorobenzene-6-id-1-yl)-4-methyl-pyridine; iridium; 2-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]pyridine Formula: C20H13F5IrN5- MolecularWeight: 610.559736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C2=C(C=C(C=[C-]2)F)F.C1=CC=NC(=C1)C2=NNC(=N2)C(F)(F)F.[Ir]

Isomeric SMILES

CC1=CC(=NC=C1)C2=C(C=C(C=[C-]2)F)F.C1=CC=NC(=C1)C2=NNC(=N2)C(F)(F)F.[Ir]

InChI

InChI=1S/C12H8F2N.C8H5F3N4.Ir/c1-8-4-5-15-12(6-8)10-3-2-9(13)7-11(10)14;9-8(10,11)7-13-6(14-15-7)5-3-1-2-4-12-5;/h2,4-7H,1H3;1-4H,(H,13,14,15);/q-1;;