Geometry & MOs

Info

ID:	325309
PubChem CID:	126682645
Reduced:	N3H21C32 (1)
Stoich.:	A3B21C32 (1)
Weight, g/mol:	536.200097
ΔH_f, kcal/mol:	159.14
Dipole, Da:	4.54
IP(EA), eV:	-8.4(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-carbazol-9-ylphenyl)-15-phenyl-4,6,8-triazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13,15-octaene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=CC=C2)C3=CC4=C5C(=C3)N=CN=C5N(C6=CC=CC=C64)C7=CC=CC=C7

DOS

IR

Vibrations