Geometry & MOs

Info

ID:	36723
PubChem CID:	8011832
Reduced:	N2O5C21H22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	359.151492
ΔH_f, kcal/mol:	-138.85
Dipole, Da:	5.55
IP(EA), eV:	-8.82(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R)-1,1-dioxothiolan-3-yl]-2-[(4R)-4-methyl-4-(3-methylbutyl)-2,5-dioxoimidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2C#N)OCC

DOS

IR

Vibrations