Geometry & MOs

Info

ID:

318871

PubChem CID:

126653602

Reduced:

NSH20C29 (2)

Stoich.:

ABC20D29 (2)

Weight, g/mol:

942.372247

ΔHf, kcal/mol:

259.94

Dipole, Da:

0.65

IP(EA), eV:

 -7.97(-1.01)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-phenyl-3-[2,3,6,7-tetraphenyl-1-(9-phenylcarbazol-3-yl)pyrrolo[2,3-f]indol-5-yl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(SC3=CC4=C(C=C32)SC(=C4C5=CC=CC=C5)C6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=C(C=C9)N(C1=CC=CC=C1)C1=CC=CC=C1

DOS

IR

Vibrations