Geometry & MOs

Info

ID:	55602
PubChem CID:	17395641
Reduced:	ClN3O3C24H24 (1)
Stoich.:	AB3C3D24E24 (1)
Weight, g/mol:	447.171355
ΔH_f, kcal/mol:	-65.82
Dipole, Da:	1.76
IP(EA), eV:	-8.47(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methoxyphenyl)-2-[[2-(1H-indol-3-yl)-2-phenylethyl]amino]propanamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)Cl)NCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)OC

DOS

IR

Vibrations