[di(propan-2-yl)amino]-sulfaniumylidene-methanethiolate; iron(3+)

Systemtic Name: [di(propan-2-yl)amino]-sulfaniumylidene-methanethiolate; iron(3+) Openeye Name: ferric (diisopropylamino)-sulfoniumylidene-methanethiolate CAS Name: [di(propan-2-yl)amino]-sulfoniumylidenemethanethiolate; iron(3+) IUPAC Name: [di(propan-2-yl)amino]-sulfoniumylidenemethanethiolate; iron(3+) Traditional Name: ferric (diisopropylamino)-sulfoniumylidene-methanethiolate Formula: C21H45FeN3S6+3 MolecularWeight: 587.8371

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C7H15NS2.Fe/c3*1-5(2)8(6(3)4)7(9)10;/h3*5-6H,1-4H3,(H,9,10);/q;;;+3