Geometry & MOs

Info

ID:	10707
PubChem CID:	106977
Reduced:	NO2Cl4H15C16 (1)
Stoich.:	AB2C4D15E16 (1)
Weight, g/mol:	394.982739
ΔH_f, kcal/mol:	-91.21
Dipole, Da:	0.32
IP(EA), eV:	-10.1(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,6,7-tetrachloro-2-cyclooctylisoindole-1,3-dione

Drug info:

PubChemData

Smile

C1CCCC(CCC1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl

DOS

IR

Vibrations