Geometry & MOs

Info

ID:	413510
PubChem CID:	135086459
Reduced:	SO2H18C20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	242.03662
ΔH_f, kcal/mol:	5.19
Dipole, Da:	5.39
IP(EA), eV:	-8.26(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3,4,5,6-pentafluorophenyl)propane-1,2-diol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[S@](=O)C2=CC=CC(=C2C3=CC=CC=C3)OC

DOS

IR

Vibrations