Geometry & MOs

Info

ID:	352409
PubChem CID:	127283496
Reduced:	SN2O2C10H18 (1)
Stoich.:	AB2C2D10E18 (1)
Weight, g/mol:	310.164105
ΔH_f, kcal/mol:	-104.41
Dipole, Da:	4.9
IP(EA), eV:	-8.89(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]-4-ethylpiperazine-2,3-dione

Drug info:

PubChemData

Smile

CC(C(=O)N1CCNC(=O)C1(C)C)SC

DOS

IR

Vibrations