Geometry & MOs

Info

ID:

301073

PubChem CID:

123059736

Reduced:

FNO6C30H30 (1)

Stoich.:

ABC6D30E30 (1)

Weight, g/mol:

537.196294

ΔHf, kcal/mol:

-212.54

Dipole, Da:

7.64

IP(EA), eV:

 -8.55(-1.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4E)-1-(3,4-difluorophenyl)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]-5-(4-methoxy-3-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCCOC1=C(C=CC(=C1)C2/C(=C(\C3=CC(=CC=C3)OC(C)C)/O)/C(=O)C(=O)N2C4=CC(=CC=C4)F)OC

DOS

IR

Vibrations