Geometry & MOs

Info

ID:

301087

PubChem CID:

123059790

Reduced:

NF3O6H26C29 (1)

Stoich.:

AB3C6D26E29 (1)

Weight, g/mol:

541.171222

ΔHf, kcal/mol:

-324.36

Dipole, Da:

7.87

IP(EA), eV:

 -9.12(-1.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4Z)-5-(3-ethoxyphenyl)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C2/C(=C(/C3=CC(=CC=C3)OC(C)C)\O)/C(=O)C(=O)N2C4=CC(=CC=C4)OC(F)(F)F

DOS

IR

Vibrations