Geometry & MOs

Info

ID:	207811
PubChem CID:	80452760
Reduced:	ClFOSN2H12C14 (1)
Stoich.:	ABCDE2F12G14 (1)
Weight, g/mol:	272.096106
ΔH_f, kcal/mol:	-11.15
Dipole, Da:	4.72
IP(EA), eV:	-9.68(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(4-aminophenoxy)ethoxy]-2-fluorobenzonitrile

Drug info:

PubChemData

Smile

CC(C(C1=CC=C(S1)Cl)OC2=CC(=C(C=C2)C#N)F)N

DOS

IR

Vibrations