(Z)-hex-2-ene-2,4-diol; iridium(3-); 2-phenylpyridine

Systemtic Name: (Z)-hex-2-ene-2,4-diol; iridium(3-); 2-phenylpyridine Openeye Name: (Z)-hex-2-ene-2,4-diol; iridium(3-); 2-phenylpyridine CAS Name: (Z)-2-hexene-2,4-diol; iridium(3-); 2-phenylpyridine IUPAC Name: (Z)-hex-2-ene-2,4-diol; iridium(3-); 2-phenylpyridine Traditional Name: (Z)-hex-2-ene-2,4-diol; iridium(3-); 2-phenylpyridine Formula: C28H28IrN2O2-5 MolecularWeight: 616.75112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C(C)O)O.C1=CC=C([C-]=C1)C2=CC=CC=N2.C1=CC=C([C-]=C1)C2=CC=CC=N2.[Ir-3]

Isomeric SMILES

CCC(/C=C(/C)\O)O.C1=CC=C([C-]=C1)C2=CC=CC=N2.C1=CC=C([C-]=C1)C2=CC=CC=N2.[Ir-3]

InChI

InChI=1S/2C11H8N.C6H12O2.Ir/c2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-3-6(8)4-5(2)7;/h2*1-6,8-9H;4,6-8H,3H2,1-2H3;/q2*-1;;-3/b;;5-4-;