carbon monoxide; cyclopenta-1,3-diene; [ethyl-(phenylmethyl)amino]-sulfaniumylidene-methanethiolate; iron

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; [ethyl-(phenylmethyl)amino]-sulfaniumylidene-methanethiolate; iron Openeye Name: [benzyl(ethyl)amino]-sulfoniumylidene-methanethiolate; carbon monoxide; cyclopenta-1,3-diene; iron CAS Name: carbon monoxide; cyclopenta-1,3-diene; [ethyl-(phenylmethyl)amino]-sulfoniumylidenemethanethiolate; iron IUPAC Name: [benzyl(ethyl)amino]-sulfoniumylidenemethanethiolate; carbon monoxide; cyclopenta-1,3-diene; iron Traditional Name: [benzyl(ethyl)amino]-sulfoniumylidene-methanethiolate; carbon monoxide; cyclopenta-1,3-diene; iron Formula: C16H18FeNOS2- MolecularWeight: 360.29522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NS2.C5H5.CO.Fe/c1-2-11(10(12)13)8-9-6-4-3-5-7-9;1-2-4-5-3-1;1-2;/h3-7H,2,8H2,1H3,(H,12,13);1-5H;;/q;-1;;