Geometry & MOs

Info

ID:	179
PubChem CID:	2242
Reduced:	N2O5C14H18 (1)
Stoich.:	A2B5C14D18 (1)
Weight, g/mol:	294.121572
ΔH_f, kcal/mol:	-201.72
Dipole, Da:	6.67
IP(EA), eV:	-9.58(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)O)N

DOS

IR

Vibrations