Geometry & MOs

Info

ID:	12967
PubChem CID:	219214
Reduced:	SO2H7C8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	334.033351
ΔH_f, kcal/mol:	-130.66
Dipole, Da:	3.89
IP(EA), eV:	-9.07(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[4-(carboxymethyl)phenyl]disulfanyl]phenyl]acetic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(=O)O)SSC2=CC=C(C=C2)CC(=O)O

DOS

IR

Vibrations