Geometry & MOs

Info

ID:	1390
PubChem CID:	4295
Reduced:	ClN3O3H24C26 (1)
Stoich.:	AB3C3D24E26 (1)
Weight, g/mol:	461.150619
ΔH_f, kcal/mol:	-49.5
Dipole, Da:	1.2
IP(EA), eV:	-8.53(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]-N-(2-pyridin-3-ylethyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)NCCC4=CN=CC=C4

DOS

IR

Vibrations