carbon monoxide; cyclopenta-1,3-diene; iron(6+); methylbenzene

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; iron(6+); methylbenzene Openeye Name: carbon monoxide; cyclopenta-1,3-diene; iron(6+); methylbenzene CAS Name: carbon monoxide; cyclopenta-1,3-diene; iron(6+); methylbenzene IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; iron(6+); methylbenzene Traditional Name: carbon monoxide; cyclopenta-1,3-diene; iron(6+); methylbenzene Formula: C14H12FeO2+4 MolecularWeight: 268.08888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[C-]C=C1.[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[Fe+6]

Isomeric SMILES

CC1=CC=[C-]C=C1.[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[Fe+6]

InChI

InChI=1S/C7H7.C5H5.2CO.Fe/c1-7-5-3-2-4-6-7;1-2-4-5-3-1;2*1-2;/h3-6H,1H3;1-5H;;;/q2*-1;;;+6