Geometry & MOs

Info

ID:	196132
PubChem CID:	78786947
Reduced:	SF2O3H12C14 (1)
Stoich.:	AB2C3D12E14 (1)
Weight, g/mol:	280.056944
ΔH_f, kcal/mol:	-178.48
Dipole, Da:	3.67
IP(EA), eV:	-9.13(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dimethylphenyl) 4-fluorobenzenesulfonate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)OS(=O)(=O)C2=C(C=C(C=C2)F)F

DOS

IR

Vibrations