Geometry & MOs

Info

ID:

299289

PubChem CID:

117682505

Reduced:

NOH24C30 (2)

Stoich.:

ABC24D30 (2)

Weight, g/mol:

1008.465479

ΔHf, kcal/mol:

129.69

Dipole, Da:

0.91

IP(EA), eV:

 -7.53(-0.86)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-N,6-N-bis(6-tert-butyl-8-methyldibenzofuran-4-yl)-1-N,6-N-bis(4-phenylphenyl)pyrene-1,6-diamine

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C3=C(O2)C(=CC=C3)N(C4=CC=CC=C4)C5=C6C=CC7=C8C6=C(C=CC8=C(C=C7C(C)C)N(C9=CC=CC=C9)C1=CC=CC2=C1OC1=C(C=CC=C21)C)C(=C5)C(C)C

DOS

IR

Vibrations