Geometry & MOs

Info

ID:

53571

PubChem CID:

14716691

Reduced:

O7F15H23C33 (1)

Stoich.:

A7B15C23D33 (1)

Weight, g/mol:

726.073475

ΔHf, kcal/mol:

-961.47

Dipole, Da:

4.09

IP(EA), eV:

 -9.95(-1.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

hexyl 2,3,5,6-tetrafluoro-4-[4-[2,3,3,3-tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanoyl]oxybenzoyl]oxybenzoate

Drug info:

PubChemData

Smile

CCCCCC(C)OC(=O)C1=C(C(=C(C(=C1F)F)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)F)F

DOS

IR

Vibrations