Geometry & MOs

Info

ID:	41329
PubChem CID:	8145669
Reduced:	FO3N4C19H23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	321.136294
ΔH_f, kcal/mol:	-132.38
Dipole, Da:	2.16
IP(EA), eV:	-8.49(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-3-methylimidazolidine-2,4,5-trione

Drug info:

PubChemData

Smile

C1CCC(C1)N2C(=O)C(=O)N(C2=O)CN3CCN(CC3)C4=CC=C(C=C4)F

DOS

IR

Vibrations