bicyclo[2.2.1]hepta-2,5-diene; carbon monoxide; iron; methanethiolate

Systemtic Name: bicyclo[2.2.1]hepta-2,5-diene; carbon monoxide; iron; methanethiolate Openeye Name: bicyclo[2.2.1]hepta-2,5-diene; carbon monoxide; iron; methanethiolate CAS Name: bicyclo[2.2.1]hepta-2,5-diene; carbon monoxide; iron; methanethiolate IUPAC Name: bicyclo[2.2.1]hepta-2,5-diene; carbon monoxide; iron; methanethiolate Traditional Name: bicyclo[2.2.1]hepta-2,5-diene; carbon monoxide; iron; methanethiolate Formula: C13H14Fe2O4S2-2 MolecularWeight: 410.06786

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Descriptors Computed from Structure

Canonical SMILES:

C[S-].C[S-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1C2C=CC1C=C2.[Fe].[Fe]

Isomeric SMILES

C[S-].C[S-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1C2C=CC1C=C2.[Fe].[Fe]

InChI

InChI=1S/C7H8.4CO.2CH4S.2Fe/c1-2-7-4-3-6(1)5-7;6*1-2;;/h1-4,6-7H,5H2;;;;;2*2H,1H3;;/p-2