carbon monoxide; cyclopenta-1,3-diene; iron; 4-methylbenzenesulfinate

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; iron; 4-methylbenzenesulfinate Openeye Name: carbon monoxide; cyclopenta-1,3-diene; iron; 4-methylbenzenesulfinate CAS Name: carbon monoxide; cyclopenta-1,3-diene; iron; 4-methylbenzenesulfinate IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; iron; 4-methylbenzenesulfinate Traditional Name: carbon monoxide; cyclopenta-1,3-diene; iron; 4-methylbenzenesulfinate Formula: C14H12FeO4S-2 MolecularWeight: 332.15268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)[O-].[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[Fe]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)[O-].[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.[Fe]

InChI

InChI=1S/C7H8O2S.C5H5.2CO.Fe/c1-6-2-4-7(5-3-6)10(8)9;1-2-4-5-3-1;2*1-2;/h2-5H,1H3,(H,8,9);1-5H;;;/q;-1;;;/p-1