Geometry & MOs

Info

ID:	267639
PubChem CID:	103583077
Reduced:	BrClN2F3H7C12 (1)
Stoich.:	ABC2D3E7F12 (1)
Weight, g/mol:	371.98763
ΔH_f, kcal/mol:	-106.79
Dipole, Da:	4.08
IP(EA), eV:	-8.96(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(3,4,5-trimethoxyphenyl)pyridin-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations