iridium; 3-phenylisoquinoline; thiocyanic acid

Systemtic Name: iridium; 3-phenylisoquinoline; thiocyanic acid Openeye Name: iridium; 3-phenylisoquinoline; thiocyanic acid CAS Name: iridium; 3-phenylisoquinoline; thiocyanic acid IUPAC Name: iridium; 3-phenylisoquinoline; thiocyanic acid Traditional Name: iridium; 3-phenylisoquinoline; thiocyanic acid Formula: C17H12IrN3S2- MolecularWeight: 514.64428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C([C-]=C1)C2=CC3=CC=CC=C3C=N2.C(#N)S.C(#N)S.[Ir]

Isomeric SMILES

C1=CC=C([C-]=C1)C2=CC3=CC=CC=C3C=N2.C(#N)S.C(#N)S.[Ir]

InChI

InChI=1S/C15H10N.2CHNS.Ir/c1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-16-15;2*2-1-3;/h1-6,8-11H;2*3H;/q-1;;;