Geometry & MOs

Info

ID:

300587

PubChem CID:

123044252

Reduced:

FNO6H28C30 (1)

Stoich.:

ABC6D28E30 (1)

Weight, g/mol:

508.103729

ΔHf, kcal/mol:

-212.09

Dipole, Da:

10.4

IP(EA), eV:

 -9.09(-1.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-1-(4-chloro-2-methylphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-5-(4-hydroxy-3-nitrophenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=C(C=C3)C(=O)OCC(C)C)C4=CC=CC=C4F)/O

DOS

IR

Vibrations