Geometry & MOs

Info

ID:	3766
PubChem CID:	10139
Reduced:	F2Cl3H9C14 (1)
Stoich.:	A2B3C9D14 (1)
Weight, g/mol:	319.97379
ΔH_f, kcal/mol:	-73.42
Dipole, Da:	1.33
IP(EA), eV:	-9.82(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-4-[2,2,2-trichloro-1-(4-fluorophenyl)ethyl]benzene

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(C2=CC=C(C=C2)F)C(Cl)(Cl)Cl)F

DOS

IR

Vibrations