Geometry & MOs

Info

ID:	370895
PubChem CID:	127341221
Reduced:	SN4O4C18H26 (1)
Stoich.:	AB4C4D18E26 (1)
Weight, g/mol:	310.236876
ΔH_f, kcal/mol:	-148.16
Dipole, Da:	9.08
IP(EA), eV:	-9.41(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-[3-(2-ethyl-3-oxopiperazin-1-yl)-2-methylpropyl]piperazin-2-one

Drug info:

PubChemData

Smile

CCC1C(=O)NCCN1CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

DOS

IR

Vibrations