Geometry & MOs

Info

ID:	6227
PubChem CID:	67562
Reduced:	F5H5C8 (1)
Stoich.:	A5B5C8 (1)
Weight, g/mol:	196.031141
ΔH_f, kcal/mol:	-239.43
Dipole, Da:	3.87
IP(EA), eV:	-10.58(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(difluoromethyl)-2-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations