Geometry & MOs

Info

ID:	205438
PubChem CID:	80100791
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	260.084872
ΔH_f, kcal/mol:	-121.19
Dipole, Da:	6.5
IP(EA), eV:	-9.31(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenyl)-3-(4-hydroxyphenyl)propanoic acid

Drug info:

PubChemData

Smile

C1CC(CNC1)(CC2=CC=C(C=C2)O)C(=O)O

DOS

IR

Vibrations