Geometry & MOs

Info

ID:	277099
PubChem CID:	103826709
Reduced:	BrClON2C16H20 (1)
Stoich.:	ABCD2E16F20 (1)
Weight, g/mol:	371.96987
ΔH_f, kcal/mol:	-34.55
Dipole, Da:	4.54
IP(EA), eV:	-8.62(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CN1C2CCC1CC(C2)CNC(=O)C3=CC(=CC(=C3)Br)Cl

DOS

IR

Vibrations