Geometry & MOs

Info

ID:	158401
PubChem CID:	56463570
Reduced:	ON4C25H34 (1)
Stoich.:	AB4C25D34 (1)
Weight, g/mol:	401.24269
ΔH_f, kcal/mol:	4.42
Dipole, Da:	4.34
IP(EA), eV:	-8.49(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-ethyl-2,3-dioxopiperazin-1-yl)-N-[2-(4-methylpiperazin-1-yl)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)C3=CC=CC(=C3)CN4CCCC4

DOS

IR

Vibrations