Geometry & MOs

Info

ID:	72459
PubChem CID:	48416199
Reduced:	N2O4C23H26 (1)
Stoich.:	A2B4C23D26 (1)
Weight, g/mol:	355.178358
ΔH_f, kcal/mol:	-127.64
Dipole, Da:	4.78
IP(EA), eV:	-8.71(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)CC2=CNC3=CC=CC=C32)C(=O)OC

DOS

IR

Vibrations