Geometry & MOs

Info

ID:	441889
PubChem CID:	135246472
Reduced:	N2O3H22C25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	317.96156
ΔH_f, kcal/mol:	-2.32
Dipole, Da:	3.39
IP(EA), eV:	-8.72(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-[6-(trifluoromethyl)pyridin-3-yl]oxypyridine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC2=NC=C(C=C2)OC3=C(C=CC=N3)C4=CC=CC=C4OC

DOS

IR

Vibrations