Geometry & MOs

Info

ID:	394937
PubChem CID:	135024192
Reduced:	NSO3H19C24 (1)
Stoich.:	ABC3D19E24 (1)
Weight, g/mol:	447.1293
ΔH_f, kcal/mol:	-30.52
Dipole, Da:	6.88
IP(EA), eV:	-8.23(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methylphenyl)sulfonyl-8-phenylbenzo[b]carbazole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C4=C2C=C5C=C(C=CC5=C4)OC

DOS

IR

Vibrations