TOLUENE-3,4-DITHIOLATO ZINC(26293-80-1) IR1
Product NameTOLUENE-3,4-DITHIOLATO ZINC
CAS26293-80-1
Molecular FormulaC7H6S2Zn
Molecular Weight219.64
InChIInChI=1S/C7H8S2.Zn/c1-5-2-3-6(8)7(9)4-5;/h2-4,8-9H,1H3;/q;+2/p-2
InChIKey WSPDPEGUBOEWME-UHFFFAOYSA-L
Smiles[Zn+2].C1(C)=CC=C([S-])C([S-])=C1
400 MHz in DMSO-d6
-
1H NMR 399.65 MHz C7 H6 S2 Zn 0.040 g : 0.5 ml DMSO-d6 zinc dithiol 
Assign. Shift(ppm)
A 7.190 B 7.148 C 6.430 D 2.075
Hz ppm Int.2877.69 7.201 209 2869.87 7.181 223 2857.42 7.150 217 2856.20 7.147 225 2574.22 6.442 122 2572.75 6.438 127 2566.41 6.422 116 2564.94 6.418 116 829.22 2.075 1000
KBr disc
nujol mull
