Geometry & MOs

Info

ID:	21701
PubChem CID:	589580
Reduced:	N2O2S2C5H6 (1)
Stoich.:	A2B2C2D5E6 (1)
Weight, g/mol:	189.98707
ΔH_f, kcal/mol:	-37.97
Dipole, Da:	6.87
IP(EA), eV:	-9.52(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetic acid

Drug info:

PubChemData

Smile

CC1=NN=C(S1)SCC(=O)O

DOS

IR

Vibrations