Geometry & MOs

Info

ID:	261120
PubChem CID:	103218648
Reduced:	OSN3C13H15 (1)
Stoich.:	ABC3D13E15 (1)
Weight, g/mol:	399.98394
ΔH_f, kcal/mol:	20.96
Dipole, Da:	5.75
IP(EA), eV:	-8.6(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-4-ethylphenyl)-3-chloro-4-iodobenzamide

Drug info:

PubChemData

Smile

CNC1=CC(=O)N(N=C1)CCSC2=CC=CC=C2

DOS

IR

Vibrations