Geometry & MOs

Info

ID:	9909
PubChem CID:	94610
Reduced:	H3O4C9F13 (1)
Stoich.:	A3B4C9D13 (1)
Weight, g/mol:	421.982375
ΔH_f, kcal/mol:	-789.44
Dipole, Da:	1.94
IP(EA), eV:	-11.14(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,2,3,3-tetrafluoro-3-[1,1,1,2,3,3-hexafluoro-3-(1,2,2-trifluoroethenoxy)propan-2-yl]oxypropanoate

Drug info:

PubChemData

Smile

COC(=O)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F

DOS

IR

Vibrations