Geometry & MOs

Info

ID:	279156
PubChem CID:	103841730
Reduced:	BrClNOC13H15 (1)
Stoich.:	ABCDE13F15 (1)
Weight, g/mol:	360.02402
ΔH_f, kcal/mol:	-17.9
Dipole, Da:	4.5
IP(EA), eV:	-9.71(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-[2-(dimethylamino)-2-oxoethyl]-N-propylbenzamide

Drug info:

PubChemData

Smile

CC(C)N(CC=C)C(=O)C1=CC(=C(C=C1)Cl)Br

DOS

IR

Vibrations