Geometry & MOs

Info

ID:

300596

PubChem CID:

123044563

Reduced:

NF2O7H23C28 (1)

Stoich.:

AB2C7D23E28 (1)

Weight, g/mol:

517.173667

ΔHf, kcal/mol:

-277.15

Dipole, Da:

10.82

IP(EA), eV:

 -8.93(-1.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[5-[(3Z)-3-[(3-ethoxyphenyl)-hydroxymethylidene]-1-(2-hydroxy-5-methylphenyl)-4,5-dioxopyrrolidin-2-yl]-2-methoxyphenyl] acetate

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC(=C(C=C3)F)F)C4=CC(=C(C=C4)OC)OC(=O)C)/O

DOS

IR

Vibrations