Geometry & MOs

Info

ID:	292741
PubChem CID:	117357569
Reduced:	F2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	242.111836
ΔH_f, kcal/mol:	-186.12
Dipole, Da:	3.93
IP(EA), eV:	-9.52(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3,3-difluoropropyl)phenyl]-2-methylpropanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1F)C(C)(C)CC(=O)O)C)F

DOS

IR

Vibrations