carbon monoxide; iron; (2,3,4,5-tetraphenylcyclopentyl)benzene

Systemtic Name: carbon monoxide; iron; (2,3,4,5-tetraphenylcyclopentyl)benzene Openeye Name: carbon monoxide; iron; (2,3,4,5-tetraphenylcyclopentyl)benzene CAS Name: carbon monoxide; iron; (2,3,4,5-tetraphenylcyclopentyl)benzene IUPAC Name: carbon monoxide; iron; (2,3,4,5-tetraphenylcyclopentyl)benzene Traditional Name: carbon monoxide; iron; (2,3,4,5-tetraphenylcyclopentyl)benzene Formula: C74H60Fe2O4 MolecularWeight: 1124.9558

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)C2C(C(C(C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C(C=C1)C2C(C(C(C2C3=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+].C1=CC=C(C=C1)C2C(C(C(C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.C1=CC=C(C=C1)C2C(C(C(C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[Fe].[Fe]

InChI

InChI=1S/2C35H30.4CO.2Fe/c2*1-6-16-26(17-7-1)31-32(27-18-8-2-9-19-27)34(29-22-12-4-13-23-29)35(30-24-14-5-15-25-30)33(31)28-20-10-3-11-21-28;4*1-2;;/h2*1-25,31-35H;;;;;;