bis(triphenyl-$l^{5}-phosphanylidene)azanium; carbon monoxide; iron

Systemtic Name: bis(triphenyl-$l^{5}-phosphanylidene)azanium; carbon monoxide; iron Openeye Name: bis(triphenyl-$l^{5}-phosphanylidene)ammonium; carbon monoxide; iron CAS Name: bis(triphenylphosphoranylidene)ammonium; carbon monoxide; iron IUPAC Name: bis(triphenyl-$l^{5}-phosphanylidene)azanium; carbon monoxide; iron Traditional Name: bis(triphenylphosphoranylidene)ammonium; carbon monoxide; iron Formula: C80H60Fe2N2O8P4+2 MolecularWeight: 1412.926044

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(=[N+]=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C(C=C1)P(=[N+]=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Fe].[Fe]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(=[N+]=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C(C=C1)P(=[N+]=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Fe].[Fe]

InChI

InChI=1S/2C36H30NP2.8CO.2Fe/c2*1-7-19-31(20-8-1)38(32-21-9-2-10-22-32,33-23-11-3-12-24-33)37-39(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36;8*1-2;;/h2*1-30H;;;;;;;;;;/q2*+1;;;;;;;;;;