Geometry & MOs

Info

ID:	3313
PubChem CID:	9481
Reduced:	Cl2F3H3C7 (1)
Stoich.:	A2B3C3D7 (1)
Weight, g/mol:	213.95639
ΔH_f, kcal/mol:	-153.56
Dipole, Da:	1.77
IP(EA), eV:	-10.07(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dichloro-4-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations