carbon monoxide; cyclohepta-1,3,5-triene; iron; triphenyl phosphite

Systemtic Name: carbon monoxide; cyclohepta-1,3,5-triene; iron; triphenyl phosphite Openeye Name: carbon monoxide; cyclohepta-1,3,5-triene; iron; triphenyl phosphite CAS Name: carbon monoxide; cyclohepta-1,3,5-triene; iron; phosphorous acid triphenyl ester IUPAC Name: carbon monoxide; cyclohepta-1,3,5-triene; iron; triphenyl phosphite Traditional Name: carbon monoxide; cyclohepta-1,3,5-triene; iron; phosphorous acid triphenyl ester Formula: C27H23FeO5P MolecularWeight: 514.287281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].C1C=CC=CC=C1.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.[Fe]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].C1C=CC=CC=C1.C1=CC=C(C=C1)OP(OC2=CC=CC=C2)OC3=CC=CC=C3.[Fe]

InChI

InChI=1S/C18H15O3P.C7H8.2CO.Fe/c1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18;1-2-4-6-7-5-3-1;2*1-2;/h1-15H;1-6H,7H2;;;