Geometry & MOs

Info

ID:

180700

PubChem CID:

76671022

Reduced:

F2N4O4C29H30 (1)

Stoich.:

A2B4C4D29E30 (1)

Weight, g/mol:

541.159748

ΔHf, kcal/mol:

-151.8

Dipole, Da:

9.79

IP(EA), eV:

 -8.49(-0.99)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[5-[2-[4-[(5-methoxy-3-oxo-1H-isoindol-2-yl)methyl]-2,5-dioxoimidazolidin-4-yl]ethynyl]-3-methyl-1-benzofuran-2-yl]-5-methylimidazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2=C(C=C(C=C2)C#CC3(CC(=O)NC3=O)CN4CC5=C(C4=O)C(=C(C=C5)OC)F)F

DOS

IR

Vibrations