Geometry & MOs

Info

ID:	317137
PubChem CID:	126632609
Reduced:	NH10C12 (2)
Stoich.:	AB10C12 (2)
Weight, g/mol:	445.11365
ΔH_f, kcal/mol:	99.68
Dipole, Da:	3.48
IP(EA), eV:	-7.69(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methylbenzo[b]carbazol-3-yl)dibenzothiophene 5,5-dioxide

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)N(C)C3=CC4=CC=CC=C4C=C3)C5=CC=CC=C51

DOS

IR

Vibrations