Geometry & MOs

Info

ID:	138275
PubChem CID:	52337860
Reduced:	ON2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	387.215806
ΔH_f, kcal/mol:	37.06
Dipole, Da:	2.68
IP(EA), eV:	-9.12(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3R)-1-[(3S)-1-(phenylcarbamoyl)piperidine-3-carbonyl]piperidine-3-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1CCOC2=CC=CC(=C2)C#N)CCOC3=CC=CC(=C3)C#N

DOS

IR

Vibrations