Geometry & MOs

Info

ID:	272974
PubChem CID:	103769421
Reduced:	BrClNO2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	404.91842
ΔH_f, kcal/mol:	-50.31
Dipole, Da:	2.51
IP(EA), eV:	-8.81(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2-chloro-5-methylphenyl)-2-iodobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Cl)NC(=O)C2=C(C=C(C=C2)Br)OC

DOS

IR

Vibrations