[bis(2-methylpropyl)amino]-sulfaniumylidene-methanethiolate; iron(3+)

Systemtic Name: [bis(2-methylpropyl)amino]-sulfaniumylidene-methanethiolate; iron(3+) Openeye Name: ferric (diisobutylamino)-sulfoniumylidene-methanethiolate CAS Name: [bis(2-methylpropyl)amino]-sulfoniumylidenemethanethiolate; iron(3+) IUPAC Name: [bis(2-methylpropyl)amino]-sulfoniumylidenemethanethiolate; iron(3+) Traditional Name: ferric (diisobutylamino)-sulfoniumylidene-methanethiolate Formula: C27H57FeN3S6+3 MolecularWeight: 671.99658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=[SH+])[S-].CC(C)CN(CC(C)C)C(=[SH+])[S-].CC(C)CN(CC(C)C)C(=[SH+])[S-].[Fe+3]

Isomeric SMILES

CC(C)CN(CC(C)C)C(=[SH+])[S-].CC(C)CN(CC(C)C)C(=[SH+])[S-].CC(C)CN(CC(C)C)C(=[SH+])[S-].[Fe+3]

InChI

InChI=1S/3C9H19NS2.Fe/c3*1-7(2)5-10(9(11)12)6-8(3)4;/h3*7-8H,5-6H2,1-4H3,(H,11,12);/q;;;+3