Geometry & MOs

Info

ID:	394936
PubChem CID:	135024191
Reduced:	NSO4H21C25 (1)
Stoich.:	ABC4D21E25 (1)
Weight, g/mol:	401.108565
ΔH_f, kcal/mol:	-67.35
Dipole, Da:	6.13
IP(EA), eV:	-8.08(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methoxy-5-(4-methylphenyl)sulfonylbenzo[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)OC

DOS

IR

Vibrations