Geometry & MOs

Info

ID:

442185

PubChem CID:

135250351

Reduced:

SN3H18C22 (2)

Stoich.:

AB3C18D22 (2)

Weight, g/mol:

886.447144

ΔHf, kcal/mol:

194.68

Dipole, Da:

3.25

IP(EA), eV:

 -8.18(-1.05)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)pyridin-3-yl]-3-[9-[6-(4,4,5,5-tetramethyl-2-phenylimidazol-1-yl)pyridin-3-yl]carbazol-3-yl]carbazole

Drug info:

PubChemData

Smile

CC1(CSC(=N1)C2=CN=C(C=C2)N3C4=C(C=C(C=C4)C5=CC6=C(C=C5)N(C7=CC=CC=C76)C8=NC=C(C=C8)C9=NC(CS9)(C)C)C1=CC=CC=C13)C

DOS

IR

Vibrations