Geometry & MOs

Info

ID:	266925
PubChem CID:	103580089
Reduced:	BrClN3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	355.99272
ΔH_f, kcal/mol:	10.71
Dipole, Da:	3.52
IP(EA), eV:	-8.64(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[(2,4-dimethoxyphenyl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC(CNC1=C(C=C(C=N1)Br)Cl)CN2CCCC2

DOS

IR

Vibrations