Geometry & MOs

Info

ID:	274078
PubChem CID:	103806892
Reduced:	OSCl2N2C11H16 (1)
Stoich.:	ABC2D2E11F16 (1)
Weight, g/mol:	409.94907
ΔH_f, kcal/mol:	-39.13
Dipole, Da:	2.04
IP(EA), eV:	-9.4(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-iodo-N-[2-methyl-3-(methylamino)propyl]benzamide

Drug info:

PubChemData

Smile

CCC(CC)(CN)NC(=O)C1=C(SC(=C1)Cl)Cl

DOS

IR

Vibrations