Geometry & MOs

Info

ID:	225460
PubChem CID:	85786995
Reduced:	O3C4F5H5 (1)
Stoich.:	A3B4C5D5 (1)
Weight, g/mol:	288.016492
ΔH_f, kcal/mol:	-413.26
Dipole, Da:	5.54
IP(EA), eV:	-11.8(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-chloro-3-(trifluoromethyl)phenyl]benzene-1,4-diol

Drug info:

PubChemData

Smile

CC(=O)O.C(C(F)(F)F)(O)(F)F

DOS

IR

Vibrations