Geometry & MOs

Info

ID:	268619
PubChem CID:	103600229
Reduced:	ClO2N4C13H13 (1)
Stoich.:	AB2C4D13E13 (1)
Weight, g/mol:	522.84664
ΔH_f, kcal/mol:	-18.79
Dipole, Da:	4.71
IP(EA), eV:	-9.09(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(4-bromophenyl)propyl]-2-iodobenzamide

Drug info:

PubChemData

Smile

CN(C)C1=C(C=C(C=C1)Cl)NC(=O)C2=NNC(=O)C=C2

DOS

IR

Vibrations