Geometry & MOs

Info

ID:

191788

PubChem CID:

78187902

Reduced:

N3O4H22C23 (2)

Stoich.:

A3B4C22D23 (2)

Weight, g/mol:

610.27957

ΔHf, kcal/mol:

-208.35

Dipole, Da:

3.14

IP(EA), eV:

-9.34(-0.94)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4,5-bis(1-fluoro-2-phenylethyl)-1,3-bis(3-methylnaphthalen-2-yl)imidazolidin-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(C(C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3NC(=O)OCC4=CC=CC=N4)O)O)NC(=O)C5=CC=CC=C5NC(=O)OCC6=CC=CC=N6

DOS

IR

Vibrations