Geometry & MOs

Info

ID:	297295
PubChem CID:	117614641
Reduced:	N3H31C48 (1)
Stoich.:	A3B31C48 (1)
Weight, g/mol:	610.215747
ΔH_f, kcal/mol:	248.43
Dipole, Da:	5.04
IP(EA), eV:	-8.28(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,7-diphenylcarbazol-9-yl)-9-phenylcarbazole-1,3-dicarbonitrile

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C4C(=C3)C5=CC=CC=C5N4C6=C(C=C(C7=C6C(C8=CC=CC=C87)(C9=CC=CC=C9)C1=CC=CC=C1)C#N)C#N)C

DOS

IR

Vibrations