Geometry & MOs

Info

ID:	62444
PubChem CID:	26719726
Reduced:	ClNOSH12C17 (1)
Stoich.:	ABCDE12F17 (1)
Weight, g/mol:	420.087685
ΔH_f, kcal/mol:	27.56
Dipole, Da:	5.29
IP(EA), eV:	-9.08(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-(4-ethoxyphenyl)-1,3-dioxoisoindole-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(SC=C2)C(=O)NC3=CC(=CC=C3)Cl

DOS

IR

Vibrations