carbon monoxide; cyclopenta-1,3-diene; (dimorpholin-4-ylamino)-sulfaniumylidene-methanethiolate; iron

Systemtic Name: carbon monoxide; cyclopenta-1,3-diene; (dimorpholin-4-ylamino)-sulfaniumylidene-methanethiolate; iron Openeye Name: carbon monoxide; cyclopenta-1,3-diene; (dimorpholinoamino)-sulfoniumylidene-methanethiolate; iron CAS Name: [bis(4-morpholinyl)amino]-sulfoniumylidenemethanethiolate; carbon monoxide; cyclopenta-1,3-diene; iron IUPAC Name: carbon monoxide; cyclopenta-1,3-diene; (dimorpholin-4-ylamino)-sulfoniumylidenemethanethiolate; iron Traditional Name: carbon monoxide; cyclopenta-1,3-diene; (dimorpholinoamino)-sulfoniumylidene-methanethiolate; iron Formula: C15H22FeN3O3S2- MolecularWeight: 412.32848

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].C1COCCN1N(C(=[SH+])[S-])N2CCOCC2.[CH-]1C=CC=C1.[Fe]

Isomeric SMILES

[C-]#[O+].C1COCCN1N(C(=[SH+])[S-])N2CCOCC2.[CH-]1C=CC=C1.[Fe]

InChI

InChI=1S/C9H17N3O2S2.C5H5.CO.Fe/c15-9(16)12(10-1-5-13-6-2-10)11-3-7-14-8-4-11;1-2-4-5-3-1;1-2;/h1-8H2,(H,15,16);1-5H;;/q;-1;;