carbon monoxide; iron; methanedithione; triphenyl phosphite

Systemtic Name: carbon monoxide; iron; methanedithione; triphenyl phosphite Openeye Name: carbon monoxide; iron; methanedithione; triphenyl phosphite CAS Name: carbon monoxide; iron; methanedithione; phosphorous acid triphenyl ester IUPAC Name: carbon monoxide; iron; methanedithione; triphenyl phosphite Traditional Name: carbon monoxide; iron; methanedithione; phosphorous acid triphenyl ester Formula: C39H30FeO8P2S2 MolecularWeight: 808.573222

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C(=S)=S.[Fe]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.C(=S)=S.[Fe]

InChI

InChI=1S/2C18H15O3P.2CO.CS2.Fe/c2*1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18;2*1-2;2-1-3;/h2*1-15H;;;;