Geometry & MOs

Info

ID:	248432
PubChem CID:	103081592
Reduced:	F2N3O3C9H11 (1)
Stoich.:	A2B3C3D9E11 (1)
Weight, g/mol:	226.091769
ΔH_f, kcal/mol:	-112.38
Dipole, Da:	9.42
IP(EA), eV:	-9.36(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2,2-difluoroethoxy)ethylamino]benzonitrile

Drug info:

PubChemData

Smile

C1=CC(=NC=C1NCCOCC(F)F)[N+](=O)[O-]

DOS

IR

Vibrations