Geometry & MOs

Info

ID:	135379
PubChem CID:	51863591
Reduced:	N2O2C12H21 (1)
Stoich.:	A2B2C12D21 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-64.15
Dipole, Da:	6.76
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.753298
Charge, e:	0

Chem-info

IUPAC name:

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1S)-1-(4-methylphenyl)propyl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCC[NH+](C1)C[C@@H](C)C#N

DOS

IR

Vibrations