Geometry & MOs

Info

ID:

82165

PubChem CID:

49855712

Reduced:

F3N3O4H26C29 (1)

Stoich.:

A3B3C4D26E29 (1)

Weight, g/mol:

434.141262

ΔHf, kcal/mol:

-227.62

Dipole, Da:

3.93

IP(EA), eV:

 -9.36(-1.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-4-[hydroxy-(4-propan-2-ylphenyl)methylidene]-1-(6-methylpyridazin-3-yl)-5-(5-methyl-1,3-thiazol-2-yl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2C(/C(=C(\C3=CC=C(C=C3)C4CCCCC4)/O)/C(=O)C2=O)C5=CC=C(C=C5)OC(F)(F)F

DOS

IR

Vibrations