Geometry & MOs

Info

ID:	251302
PubChem CID:	103102896
Reduced:	N2O3C12H16 (1)
Stoich.:	A2B3C12D16 (1)
Weight, g/mol:	245.137556
ΔH_f, kcal/mol:	-110.14
Dipole, Da:	8.94
IP(EA), eV:	-9.3(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-acetamido-3-[(2-amino-2-oxoethyl)-ethylamino]propanoate

Drug info:

PubChemData

Smile

CCN(CC1=CC=C(C=C1)C(=O)O)CC(=O)N

DOS

IR

Vibrations