Geometry & MOs

Info

ID:	251346
PubChem CID:	103103335
Reduced:	N3O4C13H25 (1)
Stoich.:	A3B4C13D25 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-214.04
Dipole, Da:	5.24
IP(EA), eV:	-9.8(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]phenyl]propanoic acid

Drug info:

PubChemData

Smile

CCC(CCC(=O)O)CCNC(=O)N(CC)CC(=O)N

DOS

IR

Vibrations