Geometry & MOs

Info

ID:	64251
PubChem CID:	29198704
Reduced:	SN3O4C12H15 (1)
Stoich.:	AB3C4D12E15 (1)
Weight, g/mol:	444.146741
ΔH_f, kcal/mol:	-83.54
Dipole, Da:	5.22
IP(EA), eV:	-10.33(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-2-(1H-indol-3-yl)-2-morpholin-4-ylethyl]-2-methyl-5-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)CONC1=NS(=O)(=O)C2=CC=CC=C21

DOS

IR

Vibrations