Geometry & MOs

Info

ID:	250271
PubChem CID:	103095272
Reduced:	BrON4C10H11 (1)
Stoich.:	ABC4D10E11 (1)
Weight, g/mol:	283.092104
ΔH_f, kcal/mol:	27.8
Dipole, Da:	4.91
IP(EA), eV:	-9.37(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2,4-difluorophenyl)ethylamino]benzene-1,2-dicarbonitrile

Drug info:

PubChemData

Smile

CCC1=CN=C(O1)CNC2=NC=NC=C2Br

DOS

IR

Vibrations