Geometry & MOs

Info

ID:

300753

PubChem CID:

123051123

Reduced:

NF2O3H7C12 (2)

Stoich.:

AB2C3D7E12 (2)

Weight, g/mol:

470.072571

ΔHf, kcal/mol:

-277.15

Dipole, Da:

6.9

IP(EA), eV:

 -9.54(-1.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-1-(2,4-difluorophenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(4-hydroxy-3-nitrophenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C(=C/2\C(N(C(=O)C2=O)C3=CC=C(C=C3)C(F)(F)F)C4=CC(=C(C=C4)O)[N+](=O)[O-])/O)F

DOS

IR

Vibrations