iridium; 4-[(4-isocyanophenyl)-(3-pyridin-2-ylbenzene-4-id-1-yl)amino]benzenecarbonitrile

Systemtic Name: iridium; 4-[(4-isocyanophenyl)-(3-pyridin-2-ylbenzene-4-id-1-yl)amino]benzenecarbonitrile Openeye Name: iridium; 4-(4-isocyano-N-[3-(2-pyridyl)benzene-4-id-1-yl]anilino)benzonitrile CAS Name: iridium; 4-(4-isocyano-N-[3-(2-pyridinyl)-1-benzene-4-idyl]anilino)benzonitrile IUPAC Name: iridium; 4-(4-isocyano-N-(3-pyridin-2-ylbenzene-4-id-1-yl)anilino)benzonitrile Traditional Name: iridium; 4-(4-isocyano-N-[3-(2-pyridyl)benzene-4-id-1-yl]anilino)benzonitrile Formula: C25H15IrN4- MolecularWeight: 563.6304

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)N(C2=CC=C(C=C2)C#N)C3=CC=[C-]C(=C3)C4=CC=CC=N4.[Ir]

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)N(C2=CC=C(C=C2)C#N)C3=CC=[C-]C(=C3)C4=CC=CC=N4.[Ir]

InChI

InChI=1S/C25H15N4.Ir/c1-27-21-10-14-23(15-11-21)29(22-12-8-19(18-26)9-13-22)24-6-4-5-20(17-24)25-7-2-3-16-28-25;/h2-4,6-17H;/q-1;