Geometry & MOs

Info

ID:	27268
PubChem CID:	820076
Reduced:	FON4C11H11 (1)
Stoich.:	ABC4D11E11 (1)
Weight, g/mol:	172.030649
ΔH_f, kcal/mol:	-11.12
Dipole, Da:	3.58
IP(EA), eV:	-9.07(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylimidazol-2-yl)sulfanylacetic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CN(C=N2)CC(=O)NN)F

DOS

IR

Vibrations