N,N-dipropylcarbamodithioate; oxidanylidenemolybdenum(4+); tetrasulfide

Systemtic Name: N,N-dipropylcarbamodithioate; oxidanylidenemolybdenum(4+); tetrasulfide Openeye Name: N,N-dipropylcarbamodithioate; oxomolybdenum(4+); tetrasulfide CAS Name: N,N-dipropylcarbamodithioate; oxomolybdenum(4+); tetrasulfide IUPAC Name: N,N-dipropylcarbamodithioate; oxomolybdenum(4+); tetrasulfide Traditional Name: N,N-dipropylcarbamodithioate; ketomolybdenum(4+); tetrasulfide Formula: C28H56Mo3N4O3S12 MolecularWeight: 1169.36924

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].O=[Mo+4].O=[Mo+4].O=[Mo+4].[S-2].[S-2].[S-2].[S-2]

Isomeric SMILES

CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].CCCN(CCC)C(=S)[S-].O=[Mo+4].O=[Mo+4].O=[Mo+4].[S-2].[S-2].[S-2].[S-2]

InChI

InChI=1S/4C7H15NS2.3Mo.3O.4S/c4*1-3-5-8(6-4-2)7(9)10;;;;;;;;;;/h4*3-6H2,1-2H3,(H,9,10);;;;;;;;;;/q;;;;3*+4;;;;4*-2/p-4