iridium; 2-phenyl-5-(trifluoromethyl)pyridine

Systemtic Name: iridium; 2-phenyl-5-(trifluoromethyl)pyridine Openeye Name: iridium; 2-phenyl-5-(trifluoromethyl)pyridine CAS Name: iridium; 2-phenyl-5-(trifluoromethyl)pyridine IUPAC Name: iridium; 2-phenyl-5-(trifluoromethyl)pyridine Traditional Name: iridium; 2-phenyl-5-(trifluoromethyl)pyridine Formula: C36H21F9IrN3-3 MolecularWeight: 858.774669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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