Geometry & MOs

Info

ID:

300460

PubChem CID:

121285140

Reduced:

ON3H29C47 (1)

Stoich.:

AB3C29D47 (1)

Weight, g/mol:

781.414447

ΔHf, kcal/mol:

201.33

Dipole, Da:

4.08

IP(EA), eV:

 -7.92(-0.86)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

10-[9-(2,4-dicyclohexyl-9-phenylpyrimido[4,5-b]indol-6-yl)carbazol-3-yl]-9,9-dimethylacridine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC3=C(C=C2)N(C4=C3C=C(C=C4)N5C6=C(C=C(C=C6)C7=CC=CC8=C7OC9=CC=CC=C89)C1=CC=CC=C15)C1=CC=CC=C1

DOS

IR

Vibrations