Geometry & MOs

Info

ID:	197685
PubChem CID:	78987157
Reduced:	SO2N4H8C11 (1)
Stoich.:	AB2C4D8E11 (1)
Weight, g/mol:	228.03017
ΔH_f, kcal/mol:	36.74
Dipole, Da:	4.46
IP(EA), eV:	-9.54(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(6-chloropyridine-2-carbonyl)amino]propanoic acid

Drug info:

PubChemData

Smile

COC(=O)C1=NN(C=N1)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations