Geometry & MOs

Info

ID:	251348
PubChem CID:	103103345
Reduced:	N3O4C10H17 (1)
Stoich.:	A3B4C10D17 (1)
Weight, g/mol:	245.137556
ΔH_f, kcal/mol:	-168.25
Dipole, Da:	5.44
IP(EA), eV:	-9.91(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]-propan-2-ylamino]acetic acid

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)NC(CC=C)C(=O)O

DOS

IR

Vibrations