Geometry & MOs

Info

ID:	40944
PubChem CID:	8144997
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	410.207981
ΔH_f, kcal/mol:	-146.12
Dipole, Da:	0.29
IP(EA), eV:	-9.04(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1CCN(CC1)CN2C(=O)[C@@](NC2=O)(C)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations