Geometry & MOs

Info

ID:	206402
PubChem CID:	80246669
Reduced:	SN2O2C15H22 (1)
Stoich.:	AB2C2D15E22 (1)
Weight, g/mol:	294.140199
ΔH_f, kcal/mol:	-90.46
Dipole, Da:	2.54
IP(EA), eV:	-9.05(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-3-(2-methylpropyl)-1-[(4-methylthiophen-3-yl)methyl]piperazine-2,5-dione

Drug info:

PubChemData

Smile

CCC1(C(=O)N(C(C(=O)N1)C)CC2=C(C=CS2)C)CC

DOS

IR

Vibrations