Geometry & MOs

Info

ID:	148246
PubChem CID:	53787908
Reduced:	NCl2O2H9C11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	366.194343
ΔH_f, kcal/mol:	-18.73
Dipole, Da:	2.29
IP(EA), eV:	-9.61(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2,2-dimethylpropoxyimino)-1,2-dihydroinden-5-yl]-4,5-dihydroisoindole-1,3-diol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)NC(=O)OC#CCCCl

DOS

IR

Vibrations