Geometry & MOs

Info

ID:	171959
PubChem CID:	75445903
Reduced:	NO6C21H25 (1)
Stoich.:	AB6C21D25 (1)
Weight, g/mol:	363.08735
ΔH_f, kcal/mol:	-215.87
Dipole, Da:	5.86
IP(EA), eV:	-8.49(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(2-chloro-6-methoxybenzoyl)amino]phenoxy]butanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)OCCCC(=O)O)OCC2=CC(=CC=C2)OC

DOS

IR

Vibrations