Geometry & MOs

Info

ID:	209609
PubChem CID:	80693917
Reduced:	NSF4C9H9 (1)
Stoich.:	ABC4D9E9 (1)
Weight, g/mol:	198.105608
ΔH_f, kcal/mol:	-194.77
Dipole, Da:	2.84
IP(EA), eV:	-9.15(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-(2-fluoroethoxy)-5-methylphenyl]ethanol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(F)(F)F)N)SCCF

DOS

IR

Vibrations