Geometry & MOs

Info

ID:	8714
PubChem CID:	80520
Reduced:	ClOF3H4C7 (1)
Stoich.:	ABC3D4E7 (1)
Weight, g/mol:	195.990277
ΔH_f, kcal/mol:	-192.17
Dipole, Da:	3.06
IP(EA), eV:	-9.55(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(trifluoromethyl)phenol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1O)C(F)(F)F)Cl

DOS

IR

Vibrations