Geometry & MOs

Info

ID:	53560
PubChem CID:	14716643
Reduced:	NO2H11C12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	229.095023
ΔH_f, kcal/mol:	-45.2
Dipole, Da:	5.69
IP(EA), eV:	-8.74(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,5-dioxopyrrolidin-1-yl)hexaneperoxoic acid

Drug info:

PubChemData

Smile

C1CC2=CC=CC3=C2N(C1)C(=C3)C(=O)O

DOS

IR

Vibrations