Geometry & MOs

Info

ID:	279151
PubChem CID:	103841692
Reduced:	BrClON2C16H20 (1)
Stoich.:	ABCD2E16F20 (1)
Weight, g/mol:	357.95422
ΔH_f, kcal/mol:	-30.02
Dipole, Da:	5.29
IP(EA), eV:	-8.99(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(C1)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)Br

DOS

IR

Vibrations