Geometry & MOs

Info

ID:

317072

PubChem CID:

126632427

Reduced:

N5H75C107 (1)

Stoich.:

A5B75C107 (1)

Weight, g/mol:

1430.605602

ΔHf, kcal/mol:

419.85

Dipole, Da:

1.89

IP(EA), eV:

 -8.23(-1.43)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-[3-[2,3-bis[3-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]phenyl]quinoxalin-5-yl]phenyl]-3-(9,9-dimethylfluoren-3-yl)carbazole

Drug info:

PubChemData

Smile

CC1(C2=C(C=C(C=C2)C3=CC4=C(C=C3)N(C5=CC=CC=C54)C6=CC=CC(=C6)C7=CC8=NC=C(N=C8C=C7C9=CC(=CC=C9)N2C3=C(C=C(C=C3)C3=CC4=C(C=C3)C(C3=CC=CC=C34)(C)C)C3=CC=CC=C32)C2=CC(=CC=C2)N2C3=C(C=C(C=C3)C3=CC4=C(C=C3)C(C3=CC=CC=C34)(C)C)C3=CC=CC=C32)C2=CC=CC=C21)C

DOS

IR

Vibrations