Geometry & MOs

Info

ID:	156854
PubChem CID:	56394737
Reduced:	OSN2C11H14 (2)
Stoich.:	ABC2D11E14 (2)
Weight, g/mol:	487.268236
ΔH_f, kcal/mol:	-20.43
Dipole, Da:	6.61
IP(EA), eV:	-8.34(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[2-[methyl-[1-(3-phenoxypropanoyl)piperidine-4-carbonyl]amino]acetyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(S1)C=C(S2)C(=O)NC3CCN(CC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations