Geometry & MOs

Info

ID:	392618
PubChem CID:	135017402
Reduced:	ISN2O3H27C31 (1)
Stoich.:	ABC2D3E27F31 (1)
Weight, g/mol:	638.02917
ΔH_f, kcal/mol:	6.52
Dipole, Da:	7.39
IP(EA), eV:	-8.04(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-7-ethyl-2-iodo-4-(4-methylphenyl)sulfonyl-3H-pyrido[2,3-c]carbazole

Drug info:

PubChemData

Smile

CCN1C2=C(C3=CC=CC=C31)C4=C(C=C2)N(CC(=C4C5=CC=C(C=C5)OC)I)S(=O)(=O)C6=CC=C(C=C6)C

DOS

IR

Vibrations