Geometry & MOs

Info

ID:	293584
PubChem CID:	117393918
Reduced:	FO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	256.111087
ΔH_f, kcal/mol:	-208.03
Dipole, Da:	1.69
IP(EA), eV:	-9.1(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-fluoro-4-hydroxy-3-methoxy-5-methylphenyl)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations