carbon monoxide; iron; (3E)-penta-1,3-diene

Systemtic Name: carbon monoxide; iron; (3E)-penta-1,3-diene Openeye Name: carbon monoxide; iron; (3E)-penta-1,3-diene CAS Name: carbon monoxide; iron; (3E)-penta-1,3-diene IUPAC Name: carbon monoxide; iron; (3E)-penta-1,3-diene Traditional Name: carbon monoxide; iron; (3E)-penta-1,3-diene Formula: C8H8FeO3 MolecularWeight: 207.99232

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

C/C=C/C=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C5H8.3CO.Fe/c1-3-5-4-2;3*1-2;/h3-5H,1H2,2H3;;;;/b5-4+;;;;