Geometry & MOs

Info

ID:	246818
PubChem CID:	103065035
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	256.124549
ΔH_f, kcal/mol:	-57.14
Dipole, Da:	1.89
IP(EA), eV:	-8.83(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CSCC1N2CC(=O)NC(C2=O)C3=CC=CC=C3

DOS

IR

Vibrations