Geometry & MOs

Info

ID:	267622
PubChem CID:	103583030
Reduced:	BrClON2C14H14 (1)
Stoich.:	ABCD2E14F14 (1)
Weight, g/mol:	324.00289
ΔH_f, kcal/mol:	-0.34
Dipole, Da:	3.81
IP(EA), eV:	-8.29(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(3-propan-2-ylphenyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)NC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations