Geometry & MOs

Info

ID:

395509

PubChem CID:

135025674

Reduced:

O3C12H20 (1)

Stoich.:

A3B12C20 (1)

Weight, g/mol:

724.171527

ΔHf, kcal/mol:

-130.58

Dipole, Da:

4.29

IP(EA), eV:

 -9.72(0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3,14-diphenyl-9-trimethylsilyl-8-heptacyclo[14.10.2.02,15.04,13.06,11.020,28.023,27]octacosa-1(26),2,4(13),5,7,9,11,14,16,18,20(28),21,23(27),24-tetradecaenyl) trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CC(=C)C1(OCCO1)CCC(C)(C)C=O

DOS

IR

Vibrations