Geometry & MOs

Info

ID:	246832
PubChem CID:	103065052
Reduced:	SN2O2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	256.124549
ΔH_f, kcal/mol:	-110.09
Dipole, Da:	4.71
IP(EA), eV:	-8.81(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC2(CC1)C(=O)N(CCC(=O)N2)C3CCSC3

DOS

IR

Vibrations