Geometry & MOs

Info

ID:

386851

PubChem CID:

134983141

Reduced:

C11H14 (2)

Stoich.:

A11B14 (2)

Weight, g/mol:

1214.45241

ΔHf, kcal/mol:

166.55

Dipole, Da:

3.65

IP(EA), eV:

-7.9(-0.98)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

trimethyl-[4-[2-[25,26,27,28-tetraoxo-11,17,23-tris[[4-(trimethylazaniumyl)phenyl]hydrazinylidene]-5-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3,6,9,12,15,18,21-octaenylidene]hydrazinyl]phenyl]azanium;tetrachloride

Drug info:

PubChemData

Smile

CC1=C(C2=C(C(=C1CC3=C(C(=C(C2)C(=C3C)C)C)C)C)C)C

DOS

IR

Vibrations