Geometry & MOs

Info

ID:	246820
PubChem CID:	103065037
Reduced:	SN2O2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	304.124549
ΔH_f, kcal/mol:	-89.2
Dipole, Da:	3.89
IP(EA), eV:	-8.75(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1C(=O)NC(C(=O)N1C2CCSC2)(C)C3CC3

DOS

IR

Vibrations