Geometry & MOs

Info

ID:	349781
PubChem CID:	127276173
Reduced:	ClON4C21H29 (1)
Stoich.:	ABC4D21E29 (1)
Weight, g/mol:	342.124739
ΔH_f, kcal/mol:	-36.24
Dipole, Da:	3.46
IP(EA), eV:	-8.49(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-1H-indol-3-yl)-1-[2-(1H-imidazol-2-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN1CCC(CC1)N2CCC(CC2)NC(=O)CC3=CNC4=C3C=CC(=C4)Cl

DOS

IR

Vibrations