Geometry & MOs

Info

ID:	40879
PubChem CID:	8144897
Reduced:	O2N3C18H19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	312.192331
ΔH_f, kcal/mol:	16.04
Dipole, Da:	3.74
IP(EA), eV:	-8.53(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

ethyl 1-[[(4S)-2,5-dioxo-4-propylimidazolidin-1-yl]methyl]piperidin-1-ium-4-carboxylate

Drug info:

PubChemData

Smile

C=CCC1=CC=CC(=CNNC(=O)CNC2=CC=CC=C2)C1=O

DOS

IR

Vibrations