Geometry & MOs

Info

ID:	447229
PubChem CID:	135281343
Reduced:	NSO3C6H9 (1)
Stoich.:	ABC3D6E9 (1)
Weight, g/mol:	175.030314
ΔH_f, kcal/mol:	-110.32
Dipole, Da:	6.41
IP(EA), eV:	-9.98(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-prop-2-enoylsulfanylpropanoic acid

Drug info:

PubChemData

Smile

C=CC(=O)SC[C@@H](C(=O)O)N

DOS

IR

Vibrations