Geometry & MOs

Info

ID:	251304
PubChem CID:	103102932
Reduced:	N2O3C12H16 (1)
Stoich.:	A2B3C12D16 (1)
Weight, g/mol:	204.111007
ΔH_f, kcal/mol:	-109.04
Dipole, Da:	7.18
IP(EA), eV:	-9.53(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-amino-2-oxoethyl)-ethylamino]-3-hydroxybutanoic acid

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1C(=O)O)CC(=O)N

DOS

IR

Vibrations