Geometry & MOs

Info

ID:	37322
PubChem CID:	8019639
Reduced:	ClON2H19C23 (1)
Stoich.:	ABC2D19E23 (1)
Weight, g/mol:	374.118591
ΔH_f, kcal/mol:	35.21
Dipole, Da:	3.43
IP(EA), eV:	-8.57(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2S)-2-(1H-indol-3-yl)-2-phenylethyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](CNC(=O)C2=CC=C(C=C2)Cl)C3=CNC4=CC=CC=C43

DOS

IR

Vibrations