Geometry & MOs

Info

ID:

299270

PubChem CID:

117682410

Reduced:

NOH32C34 (2)

Stoich.:

ABC32D34 (2)

Weight, g/mol:

1008.465479

ΔHf, kcal/mol:

84.4

Dipole, Da:

2.17

IP(EA), eV:

 -7.76(-0.99)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-N,6-N-bis(6-tert-butyl-9-methyldibenzofuran-4-yl)-1-N,6-N-bis(2-phenylphenyl)pyrene-1,6-diamine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=C(C(=C1)C(C)(C)C)OC3=C2C=CC=C3N(C4=CC=CC=C4)C5=C6C=CC7=C8C6=C(C=CC8=C(C=C7)N(C9=CC=CC=C9)C1=CC=CC2=C1OC1=C2C=C(C=C1C(C)(C)C)C(C)(C)C)C=C5

DOS

IR

Vibrations