Geometry & MOs

Info

ID:

53646

PubChem CID:

14717673

Reduced:

O4F15H23C27 (1)

Stoich.:

A4B15C23D27 (1)

Weight, g/mol:

900.304639

ΔHf, kcal/mol:

-872.7

Dipole, Da:

4.72

IP(EA), eV:

 -9.0(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-(12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,19-heptadecafluorononadecoxy)phenyl] 4-(4-methylhexoxy)benzoate

Drug info:

PubChemData

Smile

CCC(C)COCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

DOS

IR

Vibrations