Geometry & MOs

Info

ID:	34106
PubChem CID:	7889831
Reduced:	SN2O6C20H20 (1)
Stoich.:	AB2C6D20E20 (1)
Weight, g/mol:	323.07535
ΔH_f, kcal/mol:	-120.36
Dipole, Da:	9.22
IP(EA), eV:	-9.07(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(2-nitrophenoxy)acetate

Drug info:

PubChemData

Smile

C[C@@H]1CCN(C2=CC=CC=C2S1)C(=O)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations