Geometry & MOs

Info

ID:	317115
PubChem CID:	126632540
Reduced:	NSO2H13C19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	319.0667
ΔH_f, kcal/mol:	8.62
Dipole, Da:	5.47
IP(EA), eV:	-8.44(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-methyl-[1]benzothiolo[2,3-a]carbazole 11,11-dioxide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C3=CC4=C(C=C31)S(=O)(=O)C5=CC=CC=C54

DOS

IR

Vibrations