Geometry & MOs

Info

ID:	21201
PubChem CID:	587617
Reduced:	ClNO4C19H20 (1)
Stoich.:	ABC4D19E20 (1)
Weight, g/mol:	361.108086
ΔH_f, kcal/mol:	-145.67
Dipole, Da:	5.08
IP(EA), eV:	-8.75(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-[(4-chlorobenzoyl)amino]-4-methylphenoxy]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)OC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations