(diheptylamino)-sulfaniumylidene-methanethiolate; iron(3+)

Systemtic Name: (diheptylamino)-sulfaniumylidene-methanethiolate; iron(3+) Openeye Name: ferric (diheptylamino)-sulfoniumylidene-methanethiolate CAS Name: (diheptylamino)-sulfoniumylidenemethanethiolate; iron(3+) IUPAC Name: (diheptylamino)-sulfoniumylidenemethanethiolate; iron(3+) Traditional Name: ferric (diheptylamino)-sulfoniumylidene-methanethiolate Formula: C45H93FeN3S6+3 MolecularWeight: 924.47502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCCCCC)C(=[SH+])[S-].CCCCCCCN(CCCCCCC)C(=[SH+])[S-].CCCCCCCN(CCCCCCC)C(=[SH+])[S-].[Fe+3]

Isomeric SMILES

CCCCCCCN(CCCCCCC)C(=[SH+])[S-].CCCCCCCN(CCCCCCC)C(=[SH+])[S-].CCCCCCCN(CCCCCCC)C(=[SH+])[S-].[Fe+3]

InChI

InChI=1S/3C15H31NS2.Fe/c3*1-3-5-7-9-11-13-16(15(17)18)14-12-10-8-6-4-2;/h3*3-14H2,1-2H3,(H,17,18);/q;;;+3