Geometry & MOs

Info

ID:	37321
PubChem CID:	8019539
Reduced:	ClNO3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	374.118591
ΔH_f, kcal/mol:	-112.44
Dipole, Da:	7.3
IP(EA), eV:	-9.15(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H]1C(=O)O[C@@H](C)C(=O)NC2=CC(=CC=C2)Cl

DOS

IR

Vibrations