Geometry & MOs

Info

ID:	59152
PubChem CID:	24771301
Reduced:	ClO2F3H14C21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	372.097329
ΔH_f, kcal/mol:	-194.8
Dipole, Da:	2.85
IP(EA), eV:	-9.78(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-hydroxyphenyl)-5-[4-(trifluoromethyl)phenyl]phenyl]acetic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2)C3=CC=C(C=C3)C(F)(F)F)CC(=O)O

DOS

IR

Vibrations