Geometry & MOs

Info

ID:	5156
PubChem CID:	12677
Reduced:	O5F6C10H12 (1)
Stoich.:	A5B6C10D12 (1)
Weight, g/mol:	326.058892
ΔH_f, kcal/mol:	-540.47
Dipole, Da:	3.55
IP(EA), eV:	-11.39(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)propanedioate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(=O)OCC)C(C(F)(F)F)(C(F)(F)F)O

DOS

IR

Vibrations