Geometry & MOs

Info

ID:	85453
PubChem CID:	49875381
Reduced:	FN2S2O5H11C15 (1)
Stoich.:	AB2C2D5E11F15 (1)
Weight, g/mol:	422.040642
ΔH_f, kcal/mol:	-167.38
Dipole, Da:	1.77
IP(EA), eV:	-10.16(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(4-fluorophenyl)-1,1,3-trioxo-2-prop-2-enyl-1,2-thiazol-4-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=C(S(=O)(=O)NC2=O)C3=CC=C(C=C3)S(=O)(=O)N)F

DOS

IR

Vibrations