Geometry & MOs

Info

ID:	402817
PubChem CID:	135057389
Reduced:	FO2H11C17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	306.086764
ΔH_f, kcal/mol:	-32.84
Dipole, Da:	1.96
IP(EA), eV:	-9.38(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(E)-2-phenylethenyl]-6-(trifluoromethyl)phenyl]acetic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)/C=C/C2=COC3=C2C=CC(=C3)F

DOS

IR

Vibrations