Geometry & MOs

Info

ID:	267484
PubChem CID:	103582354
Reduced:	BrClN2F3H9C13 (1)
Stoich.:	ABC2D3E9F13 (1)
Weight, g/mol:	339.9978
ΔH_f, kcal/mol:	-109.25
Dipole, Da:	2.11
IP(EA), eV:	-8.92(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[2-(4-methoxyphenyl)ethyl]pyridin-2-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(F)(F)F)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations