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

Systemtic Name: [bis(phenylmethyl)amino]-sulfaniumylidene-methanethiolate; carbon monoxide; cyclopenta-1,3-diene; iron Openeye Name: carbon monoxide; cyclopenta-1,3-diene; (dibenzylamino)-sulfoniumylidene-methanethiolate; iron CAS Name: [bis(phenylmethyl)amino]-sulfoniumylidenemethanethiolate; carbon monoxide; cyclopenta-1,3-diene; iron IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; (dibenzylamino)-sulfoniumylidenemethanethiolate; iron Traditional Name: carbon monoxide; cyclopenta-1,3-diene; (dibenzylamino)-sulfoniumylidene-methanethiolate; iron Formula: C21H20FeNOS2- MolecularWeight: 422.3646

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[CH-]1C=CC=C1.C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=[SH+])[S-].[Fe]

Isomeric SMILES

[C-]#[O+].[CH-]1C=CC=C1.C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=[SH+])[S-].[Fe]

InChI

InChI=1S/C15H15NS2.C5H5.CO.Fe/c17-15(18)16(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14;1-2-4-5-3-1;1-2;/h1-10H,11-12H2,(H,17,18);1-5H;;/q;-1;;