Geometry & MOs

Info

ID:

378434

PubChem CID:

134224515

Reduced:

N2O5H26C34 (1)

Stoich.:

A2B5C26D34 (1)

Weight, g/mol:

678.195326

ΔHf, kcal/mol:

-89.98

Dipole, Da:

1.23

IP(EA), eV:

 -9.07(-2.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[2-(2-tert-butyl-1,3-dioxoisoindol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-2-[3-methyl-4-(2-methylphenyl)phenyl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC=C(C=C5)CC6=CC=CC=C6

DOS

IR

Vibrations