Geometry & MOs

Info

ID:	21046
PubChem CID:	587002
Reduced:	Cl2N2O4H20C23 (1)
Stoich.:	A2B2C4D20E23 (1)
Weight, g/mol:	458.080013
ΔH_f, kcal/mol:	-112.55
Dipole, Da:	3.01
IP(EA), eV:	-8.44(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-chloro-5-methoxy-4-[[2-(2-methylphenoxy)acetyl]amino]phenyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OCC(=O)NC2=C(C=C(C(=C2)Cl)NC(=O)C3=CC=C(C=C3)Cl)OC

DOS

IR

Vibrations