Geometry & MOs

Info

ID:	293589
PubChem CID:	117393945
Reduced:	FO4C13H17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	256.111087
ΔH_f, kcal/mol:	-204.29
Dipole, Da:	6.09
IP(EA), eV:	-8.75(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-fluoro-6-methoxy-3-(methoxymethyl)phenyl]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations