N,N-didodecylcarbamodithioate; sulfanylidenemolybdenum(4+)

Systemtic Name: N,N-didodecylcarbamodithioate; sulfanylidenemolybdenum(4+) Openeye Name: N,N-didodecylcarbamodithioate; thioxomolybdenum(4+) CAS Name: N,N-didodecylcarbamodithioate; sulfanylidenemolybdenum(4+) IUPAC Name: N,N-didodecylcarbamodithioate; sulfanylidenemolybdenum(4+) Traditional Name: N,N-dilaurylcarbamodithioate; thioxomolybdenum(4+) Formula: C100H200MoN4S9 MolecularWeight: 1843.2098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].S=[Mo+4]

Isomeric SMILES

CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].CCCCCCCCCCCCN(CCCCCCCCCCCC)C(=S)[S-].S=[Mo+4]

InChI

InChI=1S/4C25H51NS2.Mo.S/c4*1-3-5-7-9-11-13-15-17-19-21-23-26(25(27)28)24-22-20-18-16-14-12-10-8-6-4-2;;/h4*3-24H2,1-2H3,(H,27,28);;/q;;;;+4;/p-4