Geometry & MOs

Info

ID:

325413

PubChem CID:

126683146

Reduced:

NH31C48 (1)

Stoich.:

AB31C48 (1)

Weight, g/mol:

1116.55938

ΔHf, kcal/mol:

206.2

Dipole, Da:

1.52

IP(EA), eV:

 -8.21(-0.96)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3,8-dicyclohexyl-1-N,6-N-bis(2,4-dimethylphenyl)-1-N,6-N-bis[6-(2-methylphenyl)dibenzofuran-4-yl]pyrene-1,6-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC=C(C=C4)C5=C6C=CC=CC6=C(C7=CC=CC=C75)C8=CC9=CC=CC=C9C=C8)C1=CC=CC=C12

DOS

IR

Vibrations