Geometry & MOs

Info

ID:	72500
PubChem CID:	48416242
Reduced:	N2O6C21H26 (1)
Stoich.:	A2B6C21D26 (1)
Weight, g/mol:	381.157623
ΔH_f, kcal/mol:	-218.39
Dipole, Da:	1.78
IP(EA), eV:	-8.66(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(1-benzofuran-2-carbonylamino)methyl]-3-(4-ethoxyphenyl)propanoate

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)C(C)NC(=O)C2=CC=CO2)C(=O)OC

DOS

IR

Vibrations