Geometry & MOs

Info

ID:	292722
PubChem CID:	117357450
Reduced:	FO4C12H15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	242.095437
ΔH_f, kcal/mol:	-174.32
Dipole, Da:	5.46
IP(EA), eV:	-8.63(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-fluoro-2-methoxy-4-(methoxymethyl)phenyl]propanoic acid

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1OC)CC2(CC2)O)O)F

DOS

IR

Vibrations