Geometry & MOs

Info

ID:	346861
PubChem CID:	127271365
Reduced:	SN3O4C15H27 (1)
Stoich.:	AB3C4D15E27 (1)
Weight, g/mol:	352.211055
ΔH_f, kcal/mol:	-202.05
Dipole, Da:	4.89
IP(EA), eV:	-9.2(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethyl-2,3-dioxopiperazin-1-yl)-N-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)CCN2CCCS2(=O)=O

DOS

IR

Vibrations