Geometry & MOs

Info

ID:	293743
PubChem CID:	117398873
Reduced:	FO5C12H15 (1)
Stoich.:	AB5C12D15 (1)
Weight, g/mol:	258.106751
ΔH_f, kcal/mol:	-241.27
Dipole, Da:	5.37
IP(EA), eV:	-8.83(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(difluoromethyl)-4-methoxyphenyl]-2,2-dimethylpropanoic acid

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=C(C(=C1)F)C(C(=O)O)O)OC

DOS

IR

Vibrations