Geometry & MOs

Info

ID:	72526
PubChem CID:	48416270
Reduced:	N2O6C21H32 (1)
Stoich.:	A2B6C21D32 (1)
Weight, g/mol:	399.204573
ΔH_f, kcal/mol:	-270.7
Dipole, Da:	3.58
IP(EA), eV:	-8.74(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4-ethoxyphenyl)methyl]-3-(2-phenylmethoxypropanoylamino)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C(C(C)C)NC(=O)OCC)C(=O)OC

DOS

IR

Vibrations