Geometry & MOs

Info

ID:	23327
PubChem CID:	603103
Reduced:	SN3O5H13C18 (1)
Stoich.:	AB3C5D13E18 (1)
Weight, g/mol:	383.057592
ΔH_f, kcal/mol:	-42.23
Dipole, Da:	9.85
IP(EA), eV:	-8.67(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-nitro-N-(2-oxo-1H-benzo[cd]indol-6-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NC2=C3C=CC=C4C3=C(C=C2)NC4=O)[N+](=O)[O-]

DOS

IR

Vibrations