Geometry & MOs

Info

ID:	53662
PubChem CID:	14717700
Reduced:	SC3H3O4 (2)
Stoich.:	AB3C3D4 (2)
Weight, g/mol:	194.00132
ΔH_f, kcal/mol:	-309.46
Dipole, Da:	4.9
IP(EA), eV:	-9.88(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,3-trifluoro-1-thiophen-2-ylpropan-2-one

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1O)O)S(=O)(=O)O)S(=O)(=O)O

DOS

IR

Vibrations