Geometry & MOs

Info

ID:	48044
PubChem CID:	10536764
Reduced:	ClNOH8C12 (1)
Stoich.:	ABCD8E12 (1)
Weight, g/mol:	145.085127
ΔH_f, kcal/mol:	-2.1
Dipole, Da:	1.84
IP(EA), eV:	-8.61(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-amino-2-iminoethyl)amino]propanoic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC(=C(C=C3N2)O)Cl

DOS

IR

Vibrations