Geometry & MOs

Info

ID:	273974
PubChem CID:	103806207
Reduced:	ClION2C13H16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	225.147727
ΔH_f, kcal/mol:	-18.53
Dipole, Da:	3.62
IP(EA), eV:	-8.79(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-5-[3-(methylamino)piperidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CNC1CCCN(C1)C(=O)C2=C(C=CC(=C2)Cl)I

DOS

IR

Vibrations