Geometry & MOs

Info

ID:	325369
PubChem CID:	126682944
Reduced:	N4H24C37 (1)
Stoich.:	A4B24C37 (1)
Weight, g/mol:	534.209599
ΔH_f, kcal/mol:	195.09
Dipole, Da:	2.29
IP(EA), eV:	-7.93(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-carbazol-9-ylphenyl)-15-phenyl-8-azatetracyclo[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(=NC(=N2)C3=CC4=C5C(=C3)C=CC=C5N(C6=C4C=NC=C6)C7=CC=CC=C7)C8=CC=CC=C8

DOS

IR

Vibrations