Geometry & MOs

Info

ID:	376278
PubChem CID:	134222288
Reduced:	OF3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	230.110693
ΔH_f, kcal/mol:	-161.87
Dipole, Da:	3.83
IP(EA), eV:	-9.33(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-4-[4-(fluoromethoxy)phenyl]benzene

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)OCF)F

DOS

IR

Vibrations