barium(2+); (4-methoxyphenoxy)methanedithioate

Systemtic Name: barium(2+); (4-methoxyphenoxy)methanedithioate Openeye Name: barium(2+); (4-methoxyphenoxy)methanedithioate CAS Name: barium(2+); (4-methoxyphenoxy)methanedithioate IUPAC Name: barium(2+); (4-methoxyphenoxy)methanedithioate Traditional Name: barium(2+); (4-methoxyphenoxy)methanedithioate Formula: C16H14BaO4S4 MolecularWeight: 535.86696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=S)[S-].COC1=CC=C(C=C1)OC(=S)[S-].[Ba+2]

Isomeric SMILES

COC1=CC=C(C=C1)OC(=S)[S-].COC1=CC=C(C=C1)OC(=S)[S-].[Ba+2]

InChI

InChI=1S/2C8H8O2S2.Ba/c2*1-9-6-2-4-7(5-3-6)10-8(11)12;/h2*2-5H,1H3,(H,11,12);/q;;+2/p-2