carbon monoxide; cyclopenta-1,3-diene; iron; 1-phenylethanesulfinate

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; iron; 1-phenylethanesulfinate Openeye Name: carbon monoxide; cyclopenta-1,3-diene; iron; 1-phenylethanesulfinate CAS Name: carbon monoxide; cyclopenta-1,3-diene; iron; 1-phenylethanesulfinate IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; iron; 1-phenylethanesulfinate Traditional Name: carbon monoxide; cyclopenta-1,3-diene; iron; 1-phenylethanesulfinate Formula: C15H14FeO4S-2 MolecularWeight: 346.17926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10O2S.C5H5.2CO.Fe/c1-7(11(9)10)8-5-3-2-4-6-8;1-2-4-5-3-1;2*1-2;/h2-7H,1H3,(H,9,10);1-5H;;;/q;-1;;;/p-1