Geometry & MOs

Info

ID:	6216
PubChem CID:	67535
Reduced:	NO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	-60.88
Dipole, Da:	2.6
IP(EA), eV:	-10.25(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-ylisoindole-1,3-dione

Drug info:

PubChemData

Smile

CC(C)N1C(=O)C2=CC=CC=C2C1=O

DOS

IR

Vibrations