Geometry & MOs

Info

ID:

22605

PubChem CID:

597975

Reduced:

NO5H8C20F21 (1)

Stoich.:

AB5C8D20E21 (1)

Weight, g/mol:

741.006714

ΔHf, kcal/mol:

-1219.54

Dipole, Da:

5.09

IP(EA), eV:

 -10.42(-1.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-1-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)ethyl]phenyl] 2,2,3,3,4,4,4-heptafluorobutanoate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(CNC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)OC(=O)C(C(C(F)(F)F)(F)F)(F)F

DOS

IR

Vibrations