Geometry & MOs

Info

ID:	269761
PubChem CID:	103618962
Reduced:	ClNC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	415.97885
ΔH_f, kcal/mol:	27.77
Dipole, Da:	4.03
IP(EA), eV:	-9.35(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-iodo-N-(6-oxo-1-propylpyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

CC(CC#N)N(C)CC1=C(C(=CC=C1)Cl)Cl

DOS

IR

Vibrations