Geometry & MOs

Info

ID:	282547
PubChem CID:	103930506
Reduced:	N4C15H16 (1)
Stoich.:	A4B15C16 (1)
Weight, g/mol:	341.97707
ΔH_f, kcal/mol:	86.09
Dipole, Da:	3.6
IP(EA), eV:	-8.37(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(5-bromo-6-chloropyridin-3-yl)amino]methyl]-2-methoxyphenol

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)CNC2=CC3=CC=CC=C3N=C2

DOS

IR

Vibrations