Geometry & MOs

Info

ID:	40609
PubChem CID:	8144414
Reduced:	N3O3C16H22 (1)
Stoich.:	A3B3C16D22 (1)
Weight, g/mol:	304.166117
ΔH_f, kcal/mol:	-83.88
Dipole, Da:	2.86
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.757226
Charge, e:	1

Chem-info

IUPAC name:

(5S)-5-methyl-1-(4-methylphenyl)-3-(morpholin-4-ium-4-ylmethyl)imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)N(C(=O)N1C2=CC=C(C=C2)C)C[NH+]3CCOCC3

DOS

IR

Vibrations