Geometry & MOs

Info

ID:	72484
PubChem CID:	48416226
Reduced:	NSO5C21H25 (1)
Stoich.:	ABC5D21E25 (1)
Weight, g/mol:	371.173273
ΔH_f, kcal/mol:	-175.78
Dipole, Da:	2.85
IP(EA), eV:	-8.75(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CC(CNC(=O)CCC(=O)C2=CC=CS2)C(=O)OC

DOS

IR

Vibrations