iridium; 2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine

Systemtic Name: iridium; 2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine Openeye Name: iridium; 2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine CAS Name: iridium; 2-[4-(trifluoromethyl)-1-benzene-6-idyl]pyridine IUPAC Name: iridium; 2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine Traditional Name: iridium; 2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine Formula: C36H21F9IrN3-3 MolecularWeight: 858.774669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C12H7F3N.Ir/c3*13-12(14,15)10-6-4-9(5-7-10)11-3-1-2-8-16-11;/h3*1-4,6-8H;/q3*-1;