Geometry & MOs

Info

ID:	310263
PubChem CID:	126577540
Reduced:	SN2H18C31 (1)
Stoich.:	AB2C18D31 (1)
Weight, g/mol:	450.11907
ΔH_f, kcal/mol:	167.46
Dipole, Da:	4.32
IP(EA), eV:	-8.45(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-carbazol-9-yl-3-dibenzothiophen-3-ylbenzonitrile

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=C(C=CC(=C4)C#N)C5=CC6=C(C=C5)C7=CC=CC=C7S6

DOS

IR

Vibrations