Geometry & MOs

Info

ID:	259783
PubChem CID:	103174377
Reduced:	ON3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	324.02735
ΔH_f, kcal/mol:	3.87
Dipole, Da:	2.99
IP(EA), eV:	-8.4(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-(2-ethyl-6-methylpyridin-3-yl)oxy-4-fluoroaniline

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=N1)C)OC2=NC(=C(C=C2)N)C

DOS

IR

Vibrations