Geometry & MOs

Info

ID:	280526
PubChem CID:	103849754
Reduced:	FSO4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	260.051858
ΔH_f, kcal/mol:	-211.35
Dipole, Da:	6.42
IP(EA), eV:	-9.65(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-fluoro-4-(2-methylsulfonylethoxy)phenyl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C(C=C1)OCCS(=O)(=O)C(C)(C)C)F

DOS

IR

Vibrations