Geometry & MOs

Info

ID:	205117
PubChem CID:	80058308
Reduced:	FNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	247.100857
ΔH_f, kcal/mol:	-141.94
Dipole, Da:	3.9
IP(EA), eV:	-9.3(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-fluoro-2-(pyridin-2-ylmethoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

CCN(C1CC1)C(=O)COC2=C(C=C(C=C2)F)[C@@H](C)O

DOS

IR

Vibrations