Geometry & MOs

Info

ID:	298421
PubChem CID:	117649400
Reduced:	N3H33C49 (1)
Stoich.:	A3B33C49 (1)
Weight, g/mol:	741.278013
ΔH_f, kcal/mol:	212.48
Dipole, Da:	2.33
IP(EA), eV:	-8.13(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[9-(4-phenoxyphenyl)carbazol-2-yl]-9-(9-phenylcarbazol-2-yl)carbazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C3=CC=CC=C3C4=C2C=C(C=C4)C5=CC6=C(C=C5)C7=CC=CC=C7N6C8=CC9=C(C=C8)C1=CC=CC=C1N9C1=CC=CC=C1

DOS

IR

Vibrations