Geometry & MOs

Info

ID:	283753
PubChem CID:	104004043
Reduced:	BrClNO2C12H13 (1)
Stoich.:	ABCD2E12F13 (1)
Weight, g/mol:	346.04475
ΔH_f, kcal/mol:	-69.5
Dipole, Da:	5.08
IP(EA), eV:	-9.62(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-chloro-N-[3-(diethylamino)propyl]benzamide

Drug info:

PubChemData

Smile

C1CN(CC1CO)C(=O)C2=C(C(=CC=C2)Br)Cl

DOS

IR

Vibrations