Geometry & MOs

Info

ID:	242216
PubChem CID:	96079625
Reduced:	FO3H11C14 (1)
Stoich.:	AB3C11D14 (1)
Weight, g/mol:	246.069222
ΔH_f, kcal/mol:	-127.62
Dipole, Da:	5.16
IP(EA), eV:	-9.82(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(R)-(2-fluorophenyl)-hydroxymethyl]benzoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)[C@@H](C2=CC=CC=C2F)O)C(=O)O

DOS

IR

Vibrations