Geometry & MOs

Info

ID:	143556
PubChem CID:	53227004
Reduced:	FO2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	278.039065
ΔH_f, kcal/mol:	-106.0
Dipole, Da:	5.54
IP(EA), eV:	-9.41(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-carboxy-2-fluorophenyl)-3-fluorobenzoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations