Geometry & MOs

Info

ID:	40936
PubChem CID:	8144986
Reduced:	O2N3H19C24 (1)
Stoich.:	A2B3C19D24 (1)
Weight, g/mol:	410.207981
ΔH_f, kcal/mol:	51.87
Dipole, Da:	2.23
IP(EA), eV:	-8.9(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

ethyl 1-[[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]methyl]piperidin-1-ium-4-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C=N\NC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

DOS

IR

Vibrations