Geometry & MOs

Info

ID:	30165
PubChem CID:	840411
Reduced:	N2O6H8C11 (1)
Stoich.:	A2B6C8D11 (1)
Weight, g/mol:	253.014185
ΔH_f, kcal/mol:	-129.85
Dipole, Da:	7.0
IP(EA), eV:	-11.07(-2.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(5-chloro-1,3-dioxoisoindol-2-yl)propanoic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CCC(=O)O

DOS

IR

Vibrations