Geometry & MOs

Info

ID:	246846
PubChem CID:	103065081
Reduced:	SN2O2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	228.093249
ΔH_f, kcal/mol:	-70.15
Dipole, Da:	2.26
IP(EA), eV:	-8.74(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dimethyl-1-(thiolan-3-yl)piperazine-2,5-dione

Drug info:

PubChemData

Smile

CCC1C(=O)N(C(C(=O)N1)C2=CC=CC=C2)C3CCSC3

DOS

IR

Vibrations