3,5-dimethyl-1-(3H-thiophen-3-id-2-yl)pyrazole; iridium; (Z)-4-oxidanylpent-3-en-2-one

Systemtic Name: 3,5-dimethyl-1-(3H-thiophen-3-id-2-yl)pyrazole; iridium; (Z)-4-oxidanylpent-3-en-2-one Openeye Name: 3,5-dimethyl-1-(3H-thiophen-3-id-2-yl)pyrazole; (Z)-4-hydroxypent-3-en-2-one; iridium CAS Name: 3,5-dimethyl-1-(3H-thiophen-3-id-2-yl)pyrazole; (Z)-4-hydroxy-3-penten-2-one; iridium IUPAC Name: 3,5-dimethyl-1-(3H-thiophen-3-id-2-yl)pyrazole; (Z)-4-hydroxypent-3-en-2-one; iridium Traditional Name: 3,5-dimethyl-1-(3H-thiophen-3-id-2-yl)pyrazole; (Z)-4-hydroxypent-3-en-2-one; iridium Formula: C14H17IrN2O2S- MolecularWeight: 469.57898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=[C-]C=CS2)C.CC(=CC(=O)C)O.[Ir]

Isomeric SMILES

CC1=CC(=NN1C2=[C-]C=CS2)C.C/C(=C/C(=O)C)/O.[Ir]

InChI

InChI=1S/C9H9N2S.C5H8O2.Ir/c1-7-6-8(2)11(10-7)9-4-3-5-12-9;1-4(6)3-5(2)7;/h3,5-6H,1-2H3;3,6H,1-2H3;/q-1;;/b;4-3-;