Geometry & MOs

Info

ID:	258604
PubChem CID:	103155564
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	294.157957
ΔH_f, kcal/mol:	-122.57
Dipole, Da:	3.95
IP(EA), eV:	-8.92(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-amino-3-methoxybutanoyl)amino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)CNC(=O)CC(CN)OC

DOS

IR

Vibrations