Geometry & MOs

Info

ID:	397352
PubChem CID:	135030091
Reduced:	SN2O4C20H20 (1)
Stoich.:	AB2C4D20E20 (1)
Weight, g/mol:	388.064841
ΔH_f, kcal/mol:	-103.75
Dipole, Da:	4.01
IP(EA), eV:	-8.47(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-9-methyl-2-methylsulfonyl-4-phenyl-1,4-dihydropyrido[3,4-b]indol-3-one

Drug info:

PubChemData

Smile

CN1C2=C(C(C(=O)N(C2)S(=O)(=O)C)C3=CC=C(C=C3)OC)C4=CC=CC=C41

DOS

IR

Vibrations