Geometry & MOs

Info

ID:	64224
PubChem CID:	29198570
Reduced:	ClSN3O3C20H22 (1)
Stoich.:	ABC3D3E20F22 (1)
Weight, g/mol:	463.05653
ΔH_f, kcal/mol:	-53.6
Dipole, Da:	3.8
IP(EA), eV:	-8.35(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(2S)-2-(1H-indol-3-yl)-2-morpholin-4-ylethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1COCCN1[C@H](CNS(=O)(=O)C2=CC=CC=C2Cl)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations