Geometry & MOs

Info

ID:	1247
PubChem CID:	4040
Reduced:	NSO2C4H9 (1)
Stoich.:	ABC2D4E9 (1)
Weight, g/mol:	135.0354
ΔH_f, kcal/mol:	-88.08
Dipole, Da:	1.42
IP(EA), eV:	-9.5(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-3-sulfanylpropanoate

Drug info:

PubChemData

Smile

COC(=O)C(CS)N

DOS

IR

Vibrations