Geometry & MOs

Info

ID:	268604
PubChem CID:	103600180
Reduced:	SO2N5C11H15 (1)
Stoich.:	AB2C5D11E15 (1)
Weight, g/mol:	462.88355
ΔH_f, kcal/mol:	-19.76
Dipole, Da:	4.34
IP(EA), eV:	-9.65(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[1-(4-chlorophenyl)ethyl]-2-iodobenzamide

Drug info:

PubChemData

Smile

CC(C)CC1=NN=C(S1)NC(=O)C2=NNC(=O)CC2

DOS

IR

Vibrations