Geometry & MOs

Info

ID:

392204

PubChem CID:

135013666

Reduced:

Br4N4H7F15C37 (1)

Stoich.:

A4B4C7D15E37 (1)

Weight, g/mol:

454.329849

ΔHf, kcal/mol:

-321.63

Dipole, Da:

4.67

IP(EA), eV:

 -9.34(-2.24)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(5Z,7S,8S,9E)-12-[tert-butyl(dimethyl)silyl]oxy-3,5,7,10-tetramethyl-3-trimethylsilyldodeca-1,5,9-triene-4,8-diol

Drug info:

PubChemData

Smile

C1=CC2=C(C3=C(C(=C(N3)C4=NC(=C(C5=CC=C(N5)C(=C1N2)C6=C(C(=C(C(=C6F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C(=C4Br)Br)Br)Br)C8=C(C(=C(C(=C8F)F)F)F)F

DOS

IR

Vibrations