Geometry & MOs

Info

ID:	128779
PubChem CID:	51057619
Reduced:	NCl2O4H9C13 (1)
Stoich.:	AB2C4D9E13 (1)
Weight, g/mol:	407.99709
ΔH_f, kcal/mol:	-126.52
Dipole, Da:	7.54
IP(EA), eV:	-9.77(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-cyano-2-iodophenyl)-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)Cl)C2=CC=C(O2)C(=O)NCC(=O)O

DOS

IR

Vibrations