Geometry & MOs

Info

ID:	394935
PubChem CID:	135024190
Reduced:	NSO6H31C34 (1)
Stoich.:	ABC6D31E34 (1)
Weight, g/mol:	431.119129
ΔH_f, kcal/mol:	-152.68
Dipole, Da:	9.74
IP(EA), eV:	-8.42(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8,9-dimethoxy-5-(4-methylphenyl)sulfonylbenzo[b]carbazole

Drug info:

PubChemData

Smile

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)CC4=CC=CC5=CC=CC=C54)C(=O)OCC

DOS

IR

Vibrations