Geometry & MOs

Info

ID:	206401
PubChem CID:	80246668
Reduced:	N2S2O3C12H16 (1)
Stoich.:	A2B2C3D12E16 (1)
Weight, g/mol:	294.140199
ΔH_f, kcal/mol:	-59.97
Dipole, Da:	5.12
IP(EA), eV:	-8.96(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-diethyl-6-methyl-1-[(3-methylthiophen-2-yl)methyl]piperazine-2,5-dione

Drug info:

PubChemData

Smile

CC1=CSC=C1CNS(=O)(=O)C2=CC=C(O2)CNC

DOS

IR

Vibrations