Geometry & MOs

Info

ID:	3670
PubChem CID:	9966
Reduced:	O2F3H5C8 (1)
Stoich.:	A2B3C5D8 (1)
Weight, g/mol:	190.024164
ΔH_f, kcal/mol:	-219.33
Dipole, Da:	2.59
IP(EA), eV:	-10.94(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(trifluoromethyl)benzoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations