Geometry & MOs

Info

ID:	246836
PubChem CID:	103065057
Reduced:	SN2O2C16H26 (1)
Stoich.:	AB2C2D16E26 (1)
Weight, g/mol:	270.140199
ΔH_f, kcal/mol:	-121.54
Dipole, Da:	3.21
IP(EA), eV:	-8.65(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1C(=O)NC2(CCCCC2)C(=O)N1C3CCSC3

DOS

IR

Vibrations