Geometry & MOs

Info

ID:	197313
PubChem CID:	78951487
Reduced:	FSO2C10H13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	255.018784
ΔH_f, kcal/mol:	-128.79
Dipole, Da:	1.47
IP(EA), eV:	-8.64(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[3-fluoro-4-(1,3-thiazol-2-ylsulfanyl)phenyl]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C1=C(C=CC=C1SCCO)F)O

DOS

IR

Vibrations