Geometry & MOs

Info

ID:	382306
PubChem CID:	134973376
Reduced:	H4S4F6C7 (1)
Stoich.:	A4B4C6D7 (1)
Weight, g/mol:	391.958725
ΔH_f, kcal/mol:	-266.23
Dipole, Da:	7.85
IP(EA), eV:	-9.52(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3,3,3-trifluoro-2-[4-(1,1,1,3,3,3-hexafluoropropan-2-ylidene)-1,3-dithietan-2-ylidene]propanoate

Drug info:

PubChemData

Smile

C1CSC2(S1)SC(=C(C(F)(F)F)C(F)(F)F)S2

DOS

IR

Vibrations