Geometry & MOs

Info

ID:	25399
PubChem CID:	624119
Reduced:	OCl2N4H10C14 (1)
Stoich.:	AB2C4D10E14 (1)
Weight, g/mol:	419.94545
ΔH_f, kcal/mol:	6.29
Dipole, Da:	3.34
IP(EA), eV:	-9.09(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-1-yl) 2-(4-hydroxy-3-iodo-5-nitrophenyl)acetate

Drug info:

PubChemData

Smile

CC(=O)NC1=NC2=C(C3=C(C=C2)C(=C(C=C3)Cl)Cl)C(=N1)N

DOS

IR

Vibrations