Geometry & MOs

Info

ID:	261533
PubChem CID:	103238871
Reduced:	ClN3O4C12H14 (1)
Stoich.:	AB3C4D12E14 (1)
Weight, g/mol:	158.069142
ΔH_f, kcal/mol:	-160.02
Dipole, Da:	3.78
IP(EA), eV:	-9.75(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[(1-amino-1-oxopropan-2-yl)amino]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC(C(=O)N)NCC(=O)NC1=C(C=CC(=C1)C(=O)O)Cl

DOS

IR

Vibrations