Geometry & MOs

Info

ID:	41327
PubChem CID:	8145667
Reduced:	NO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	375.183244
ΔH_f, kcal/mol:	-86.53
Dipole, Da:	6.4
IP(EA), eV:	-9.58(0.71)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=C)[C@@H]1CC[C@]2([C@@]1(N(C(=O)O2)CC=C)C)C

DOS

IR

Vibrations