Geometry & MOs

Info

ID:	310416
PubChem CID:	126580011
Reduced:	SN3H25C43 (1)
Stoich.:	AB3C25D43 (1)
Weight, g/mol:	706.24427
ΔH_f, kcal/mol:	228.19
Dipole, Da:	5.19
IP(EA), eV:	-8.19(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-(4-dibenzothiophen-4-ylphenyl)-12-(9,9-dimethylfluoren-2-yl)indolo[2,3-a]carbazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N2C3=C(C=CC(=C3)C#N)C4=C2C5=C(C=C4)C6=CC=CC=C6N5C7=CC=C(C=C7)C8=CC=CC9=C8SC1=CC=CC=C91

DOS

IR

Vibrations