Geometry & MOs

Info

ID:	41659
PubChem CID:	8146713
Reduced:	O2N3C21H26 (1)
Stoich.:	A2B3C21D26 (1)
Weight, g/mol:	351.194677
ΔH_f, kcal/mol:	-21.05
Dipole, Da:	1.64
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.797819
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC[C@@]1(C(=O)N(C(=O)N1)C[NH+](CC)CC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations