Geometry & MOs

Info

ID:	7628
PubChem CID:	73559
Reduced:	NO2C8H11 (1)
Stoich.:	AB2C8D11 (1)
Weight, g/mol:	153.078979
ΔH_f, kcal/mol:	-98.08
Dipole, Da:	3.72
IP(EA), eV:	-10.6(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Drug info:

PubChemData

Smile

C1CCC2C(C1)C(=O)NC2=O

DOS

IR

Vibrations