Geometry & MOs

Info

ID:	64308
PubChem CID:	29199036
Reduced:	ClSO2N4C21H25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	432.138675
ΔH_f, kcal/mol:	-10.02
Dipole, Da:	5.77
IP(EA), eV:	-8.48(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(2S)-2-(1H-indol-3-yl)-2-(4-methylpiperazin-1-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)[C@@H](CNS(=O)(=O)C2=CC(=CC=C2)Cl)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations