Geometry & MOs

Info

ID:	177744
PubChem CID:	76223288
Reduced:	OSN3C7H9 (1)
Stoich.:	ABC3D7E9 (1)
Weight, g/mol:	131.058243
ΔH_f, kcal/mol:	36.08
Dipole, Da:	5.19
IP(EA), eV:	-8.8(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dihydroxypiperidin-2-one

Drug info:

PubChemData

Smile

CC(=NC(=S)NN)C1=CC=CO1

DOS

IR

Vibrations