Geometry & MOs

Info

ID:	72427
PubChem CID:	48416165
Reduced:	NO4C22H27 (1)
Stoich.:	AB4C22D27 (1)
Weight, g/mol:	401.183838
ΔH_f, kcal/mol:	-153.69
Dipole, Da:	6.96
IP(EA), eV:	-8.65(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C2=CC=CC(=C2C)C)C(=O)OC

DOS

IR

Vibrations