1,2-bis(4-methoxyphenyl)ethane-1,2-dithiolate; nickel(2+); tetrabutylazanium

Systemtic Name: 1,2-bis(4-methoxyphenyl)ethane-1,2-dithiolate; nickel(2+); tetrabutylazanium Openeye Name: nickelous; 1,2-bis(4-methoxyphenyl)ethane-1,2-dithiolate; tetrabutylammonium CAS Name: 1,2-bis(4-methoxyphenyl)ethane-1,2-dithiolate; nickel(2+); tetrabutylammonium IUPAC Name: 1,2-bis(4-methoxyphenyl)ethane-1,2-dithiolate; nickel(2+); tetrabutylazanium Traditional Name: nickelous; 1,2-bis(4-methoxyphenyl)ethane-1,2-dithiolate; tetrabutylammonium Formula: C48H68NNiO4S4- MolecularWeight: 910.01122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.COC1=CC=C(C=C1)C(C(C2=CC=C(C=C2)OC)[S-])[S-].COC1=CC=C(C=C1)C(C(C2=CC=C(C=C2)OC)[S-])[S-].[Ni+2]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.COC1=CC=C(C=C1)C(C(C2=CC=C(C=C2)OC)[S-])[S-].COC1=CC=C(C=C1)C(C(C2=CC=C(C=C2)OC)[S-])[S-].[Ni+2]

InChI

InChI=1S/C16H36N.2C16H18O2S2.Ni/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2*1-17-13-7-3-11(4-8-13)15(19)16(20)12-5-9-14(18-2)10-6-12;/h5-16H2,1-4H3;2*3-10,15-16,19-20H,1-2H3;/q+1;;;+2/p-4