Geometry & MOs

Info

ID:	268611
PubChem CID:	103600200
Reduced:	INO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	508.83099
ΔH_f, kcal/mol:	-44.63
Dipole, Da:	3.15
IP(EA), eV:	-9.14(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(2-bromophenyl)ethyl]-2-iodobenzamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(C)NC(=O)C2=C(C=CC(=C2)I)O

DOS

IR

Vibrations