Geometry & MOs

Info

ID:	24573
PubChem CID:	611201
Reduced:	FH3Cl4C7 (1)
Stoich.:	AB3C4D7 (1)
Weight, g/mol:	247.894339
ΔH_f, kcal/mol:	-49.74
Dipole, Da:	3.78
IP(EA), eV:	-10.18(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-3-fluoro-2-(trichloromethyl)benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations