Geometry & MOs

Info

ID:	286288
PubChem CID:	104169992
Reduced:	FSO3C10H13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	232.056944
ΔH_f, kcal/mol:	-158.59
Dipole, Da:	5.76
IP(EA), eV:	-10.15(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-4-(2-methoxypropylsulfonyl)benzene

Drug info:

PubChemData

Smile

CC(CS(=O)(=O)C1=CC=CC=C1F)OC

DOS

IR

Vibrations