Geometry & MOs

Info

ID:	266937
PubChem CID:	103580129
Reduced:	BrClON3H9C10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	291.9978
ΔH_f, kcal/mol:	40.83
Dipole, Da:	3.75
IP(EA), eV:	-8.86(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(1-ethoxypropan-2-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NO1)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations