Geometry & MOs

Info

ID:	11679
PubChem CID:	118955
Reduced:	NO2S2C5H5 (1)
Stoich.:	AB2C2D5E5 (1)
Weight, g/mol:	174.976171
ΔH_f, kcal/mol:	-50.96
Dipole, Da:	4.99
IP(EA), eV:	-9.4(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-sulfanyl-1,3-thiazol-4-yl)acetic acid

Drug info:

PubChemData

Smile

C1=C(N=C(S1)S)CC(=O)O

DOS

IR

Vibrations