Geometry & MOs

Info

ID:	158887
PubChem CID:	57244142
Reduced:	SO5C36H46 (1)
Stoich.:	AB5C36D46 (1)
Weight, g/mol:	282.947529
ΔH_f, kcal/mol:	-192.7
Dipole, Da:	6.79
IP(EA), eV:	-8.71(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propane-2-sulfinate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CCOC2CC(SC(C2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

DOS

IR

Vibrations