2-(3-ethynylbenzene-6-id-1-yl)pyridine; iridium(3+)

Systemtic Name: 2-(3-ethynylbenzene-6-id-1-yl)pyridine; iridium(3+) Openeye Name: 2-(3-ethynylbenzene-6-id-1-yl)pyridine; iridium(3+) CAS Name: 2-(3-ethynyl-1-benzene-6-idyl)pyridine; iridium(3+) IUPAC Name: 2-(3-ethynylbenzene-6-id-1-yl)pyridine; iridium(3+) Traditional Name: 2-(3-ethynylbenzene-6-id-1-yl)pyridine; iridium(3+) Formula: C39H24IrN3 MolecularWeight: 726.84496

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=[C-]C(=C1)C2=CC=CC=N2.C#CC1=CC=[C-]C(=C1)C2=CC=CC=N2.C#CC1=CC=[C-]C(=C1)C2=CC=CC=N2.[Ir+3]

Isomeric SMILES

C#CC1=CC=[C-]C(=C1)C2=CC=CC=N2.C#CC1=CC=[C-]C(=C1)C2=CC=CC=N2.C#CC1=CC=[C-]C(=C1)C2=CC=CC=N2.[Ir+3]

InChI

InChI=1S/3C13H8N.Ir/c3*1-2-11-6-5-7-12(10-11)13-8-3-4-9-14-13;/h3*1,3-6,8-10H;/q3*-1;+3