Geometry & MOs

Info

ID:	410354
PubChem CID:	135083149
Reduced:	S2O3H6F10C15 (1)
Stoich.:	A2B3C6D10E15 (1)
Weight, g/mol:	698.02633
ΔH_f, kcal/mol:	-561.95
Dipole, Da:	6.66
IP(EA), eV:	-9.86(-2.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,7-ditert-butyl-2,8-difluoro-5-(1,1,2,2,3,3,3-heptafluoropropyl)dibenzoselenophen-5-yl] trifluoromethanesulfonate

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1F)C3=C(S2(C(C(F)(F)F)(F)F)OS(=O)(=O)C(F)(F)F)C=CC(=C3)F

DOS

IR

Vibrations