Geometry & MOs

Info

ID:	270991
PubChem CID:	103639106
Reduced:	BrNOC16H16 (1)
Stoich.:	ABCD16E16 (1)
Weight, g/mol:	414.90687
ΔH_f, kcal/mol:	-15.83
Dipole, Da:	4.37
IP(EA), eV:	-8.93(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-4-iodobenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NC2=C(C(=CC=C2)Br)C)C

DOS

IR

Vibrations