Geometry & MOs

Info

ID:	72423
PubChem CID:	48416161
Reduced:	N3O4C19H23 (1)
Stoich.:	A3B4C19D23 (1)
Weight, g/mol:	401.183838
ΔH_f, kcal/mol:	-120.85
Dipole, Da:	5.43
IP(EA), eV:	-8.7(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-ethoxyphenyl)methyl]-3-[[2-(4-methoxyphenoxy)acetyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2=NC=C(N=C2)C)C(=O)OC

DOS

IR

Vibrations