Geometry & MOs

Info

ID:	277156
PubChem CID:	103827068
Reduced:	BrClO2N3H9C11 (1)
Stoich.:	ABC2D3E9F11 (1)
Weight, g/mol:	318.01345
ΔH_f, kcal/mol:	0.7
Dipole, Da:	2.81
IP(EA), eV:	-10.04(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[2-(dimethylamino)ethyl]-N-methylbenzamide

Drug info:

PubChemData

Smile

C1=C(C=C(C=C1Cl)Br)C(=O)NCCC2=NC=NO2

DOS

IR

Vibrations