Geometry & MOs

Info

ID:	267660
PubChem CID:	103583212
Reduced:	BrClN2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	338.9774
ΔH_f, kcal/mol:	29.56
Dipole, Da:	3.26
IP(EA), eV:	-8.54(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(5-bromo-3-chloropyridin-2-yl)amino]phenyl]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=C)C)C1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations