Geometry & MOs

Info

ID:	271836
PubChem CID:	103693786
Reduced:	FNO2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	268.034729
ΔH_f, kcal/mol:	-81.76
Dipole, Da:	6.04
IP(EA), eV:	-9.68(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-5-(2,3,4-trifluorophenyl)benzoic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C2=C(N=CC=C2)C(=O)O

DOS

IR

Vibrations