Geometry & MOs

Info

ID:	122676
PubChem CID:	50816871
Reduced:	SN3O3C25H31 (1)
Stoich.:	AB3C3D25E31 (1)
Weight, g/mol:	420.216141
ΔH_f, kcal/mol:	-87.99
Dipole, Da:	4.49
IP(EA), eV:	-8.35(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC(C)C(C1=CC=CS1)NC(=O)CC2CCN(CC2)C(=O)C3=CC4=C(N3)C=C(C=C4)OC

DOS

IR

Vibrations