Geometry & MOs

Info

ID:	317138
PubChem CID:	126632621
Reduced:	NSO2H19C29 (1)
Stoich.:	ABC2D19E29 (1)
Weight, g/mol:	445.11365
ΔH_f, kcal/mol:	48.96
Dipole, Da:	4.65
IP(EA), eV:	-8.19(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methylbenzo[h]carbazol-4-yl)dibenzothiophene 5,5-dioxide

Drug info:

PubChemData

Smile

CN1C2=CC3=CC=CC=C3C=C2C4=C1C=C(C=C4)C5=CC6=C(C=C5)C7=CC=CC=C7S6(=O)=O

DOS

IR

Vibrations