Geometry & MOs

Info

ID:

406124

PubChem CID:

135076599

Reduced:

NNaO2C7H8 (1)

Stoich.:

ABC2D7E8 (1)

Weight, g/mol:

1385.928007

ΔHf, kcal/mol:

-109.74

Dipole, Da:

7.22

IP(EA), eV:

-9.88(0.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[6-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-1-[6-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-2-(trifluoromethylsulfonyloxy)naphthalen-1-yl]naphthalen-2-yl] trifluoromethanesulfonate

Drug info:

PubChemData

Smile

C1CCC(C1)(C#N)C(=O)[O-].[Na+]

DOS

IR

Vibrations