N,N-dicyclohexylcarbamodithioate; sulfanylidenemolybdenum(4+)

Systemtic Name: N,N-dicyclohexylcarbamodithioate; sulfanylidenemolybdenum(4+) Openeye Name: N,N-dicyclohexylcarbamodithioate; thioxomolybdenum(4+) CAS Name: N,N-dicyclohexylcarbamodithioate; sulfanylidenemolybdenum(4+) IUPAC Name: N,N-dicyclohexylcarbamodithioate; sulfanylidenemolybdenum(4+) Traditional Name: N,N-dicyclohexylcarbamodithioate; thioxomolybdenum(4+) Formula: C52H88MoN4S9 MolecularWeight: 1153.80692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].S=[Mo+4]

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].C1CCC(CC1)N(C2CCCCC2)C(=S)[S-].S=[Mo+4]

InChI

InChI=1S/4C13H23NS2.Mo.S/c4*15-13(16)14(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h4*11-12H,1-10H2,(H,15,16);;/q;;;;+4;/p-4