bis(oxidanylidene)molybdenum(2+); (Z)-1,2-dicyanoethene-1,2-dithiolate; tetrabutylazanium

Systemtic Name: bis(oxidanylidene)molybdenum(2+); (Z)-1,2-dicyanoethene-1,2-dithiolate; tetrabutylazanium Openeye Name: (Z)-1,2-dicyanoethene-1,2-dithiolate; dioxomolybdenum(2+); tetrabutylammonium CAS Name: (Z)-1,2-dicyanoethene-1,2-dithiolate; dioxomolybdenum(2+); tetrabutylammonium IUPAC Name: (Z)-1,2-dicyanoethene-1,2-dithiolate; dioxomolybdenum(2+); tetrabutylazanium Traditional Name: (Z)-1,2-dicyanoethene-1,2-dithiolate; diketomolybdenum(2+); tetrabutylammonium Formula: C40H72MoN6O2S4 MolecularWeight: 893.23868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C(#N)C(=C(C#N)[S-])[S-].C(#N)C(=C(C#N)[S-])[S-].O=[Mo+2]=O

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.C(#N)/C(=C(/[S-])\C#N)/[S-].C(#N)/C(=C(/[S-])\C#N)/[S-].O=[Mo+2]=O

InChI

InChI=1S/2C16H36N.2C4H2N2S2.Mo.2O/c2*1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2*5-1-3(7)4(8)2-6;;;/h2*5-16H2,1-4H3;2*7-8H;;;/q2*+1;;;+2;;/p-4/b;;2*4-3-;;;