Geometry & MOs

Info

ID:	40621
PubChem CID:	8144432
Reduced:	N3O3C16H22 (1)
Stoich.:	A3B3C16D22 (1)
Weight, g/mol:	340.166117
ΔH_f, kcal/mol:	-79.12
Dipole, Da:	2.7
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.758341
Charge, e:	1

Chem-info

IUPAC name:

(5S)-5-methyl-3-(morpholin-4-ium-4-ylmethyl)-5-naphthalen-1-ylimidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCOCC2)C3=CC=CC=C3

DOS

IR

Vibrations