iridium; triphenylphosphane; tri(pyrazol-1-yl)methanesulfonate

Systemtic Name: iridium; triphenylphosphane; tri(pyrazol-1-yl)methanesulfonate Openeye Name: iridium; triphenylphosphane; tri(pyrazol-1-yl)methanesulfonate CAS Name: iridium; triphenylphosphine; tris(1-pyrazolyl)methanesulfonate IUPAC Name: iridium; triphenylphosphane; tri(pyrazol-1-yl)methanesulfonate Traditional Name: iridium; triphenylphosphine; tri(pyrazol-1-yl)methanesulfonate Formula: C28H24IrN6O3PS- MolecularWeight: 747.784321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CN(N=C1)C(N2C=CC=N2)(N3C=CC=N3)S(=O)(=O)[O-].[Ir]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CN(N=C1)C(N2C=CC=N2)(N3C=CC=N3)S(=O)(=O)[O-].[Ir]

InChI

InChI=1S/C18H15P.C10H10N6O3S.Ir/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-20(18,19)10(14-7-1-4-11-14,15-8-2-5-12-15)16-9-3-6-13-16;/h1-15H;1-9H,(H,17,18,19);/p-1