Geometry & MOs

Info

ID:	379106
PubChem CID:	134352385
Reduced:	BrH19C29 (1)
Stoich.:	AB19C29 (1)
Weight, g/mol:	533.21435
ΔH_f, kcal/mol:	121.2
Dipole, Da:	1.92
IP(EA), eV:	-8.53(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[3-(7-phenylbenzo[a]phenalen-7-yl)phenyl]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC5=C4C2=CC=C5)C6=CC(=CC=C6)Br

DOS

IR

Vibrations