Geometry & MOs

Info

ID:	293586
PubChem CID:	117393938
Reduced:	FO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	256.111087
ΔH_f, kcal/mol:	-201.31
Dipole, Da:	5.51
IP(EA), eV:	-9.19(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluoro-2-hydroxy-3-methoxy-6-methylphenyl)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations