Geometry & MOs

Info

ID:	71460
PubChem CID:	48414912
Reduced:	ON2F3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	334.200491
ΔH_f, kcal/mol:	-130.92
Dipole, Da:	6.28
IP(EA), eV:	-9.09(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-but-3-ynylpiperazin-1-yl)-2-oxoethyl]-5,5-diethylimidazolidine-2,4-dione

Drug info:

PubChemData

Smile

C#CCCN1CCN(CC1)C(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations