Geometry & MOs

Info

ID:	41651
PubChem CID:	8146698
Reduced:	O2N3C21H26 (1)
Stoich.:	A2B3C21D26 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-36.74
Dipole, Da:	3.78
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.126100
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-[[benzyl(ethyl)amino]methyl]-5-methyl-1-(4-methylphenyl)imidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC[NH+](CC1=CC=CC=C1)CN2C(=O)[C@@H](N(C2=O)C3=CC=C(C=C3)C)C

DOS

IR

Vibrations