Geometry & MOs

Info

ID:	283682
PubChem CID:	103998552
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	331.99272
ΔH_f, kcal/mol:	-58.05
Dipole, Da:	3.09
IP(EA), eV:	-9.48(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-chloro-N-methyl-N-[3-(methylamino)-3-oxopropyl]benzamide

Drug info:

PubChemData

Smile

CN(CC(=O)N1CCCC1)C(=O)C2=CC3=C(CNC3)C=C2

DOS

IR

Vibrations