Geometry & MOs

Info

ID:	233288
PubChem CID:	89649815
Reduced:	ClN2O5C25H25 (1)
Stoich.:	AB2C5D25E25 (1)
Weight, g/mol:	164.071641
ΔH_f, kcal/mol:	-140.28
Dipole, Da:	6.31
IP(EA), eV:	-8.84(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-3-amino-6-methylpiperidin-2-one;hydrochloride

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2(CCOCC2)CNC(=O)C3=C(C=C(C=C3)NC(=O)C4=CC=CO4)Cl

DOS

IR

Vibrations