Geometry & MOs

Info

ID:	266883
PubChem CID:	103579865
Reduced:	FNOCl2C11H14 (1)
Stoich.:	ABCD2E11F14 (1)
Weight, g/mol:	284.028332
ΔH_f, kcal/mol:	-99.28
Dipole, Da:	5.05
IP(EA), eV:	-8.72(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-4-fluoro-N-(1-pyridin-3-ylethyl)aniline

Drug info:

PubChemData

Smile

CC(CCOC)NC1=CC(=C(C(=C1)Cl)F)Cl

DOS

IR

Vibrations