Geometry & MOs

Info

ID:

317076

PubChem CID:

126632431

Reduced:

NH19C27 (4)

Stoich.:

AB19C27 (4)

Weight, g/mol:

1429.610353

ΔHf, kcal/mol:

407.05

Dipole, Da:

1.13

IP(EA), eV:

 -8.18(-1.04)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-[3-[4,7-bis[3-[3-(9,9-dimethylfluoren-3-yl)carbazol-9-yl]phenyl]quinolin-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=C(C8=C(C=CN=C8C=C7)C9=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