Percentage ionic character when electronegativity is given


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> What is the ionic character of a bond, $\ce{A-B}$, in terms of the electronegativities of $\ce{A}$ and $\ce{B}$ ($\chi\_\ce{A}$ and $\chi\_\ce{B}$)?
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I have been taught that the percentage ionic character is:


$$ \frac{\text{observed value of ionic character}}{\text{calculated value of character}} $$


but I can't understand how electronegativity is used here. I couldn't find anything on the internet either.




Linus Pauling proposed an empirical relationship which relates the percent ionic character in a bond to the electronegativity difference $\Delta \chi$.


Percent ionic character $= (1-e^{-(\Delta \chi/2)^2} )\times 100$


But I'd like to correct the definition of percent ionic character in your question using dipole moment $\mu$ (not *Observed value of ionic character*):


Percent ionic character = $\Large\frac{\mu\_{\text{observed}}} {\mu\_{\text{calculated} }}$ $\times 100 \%$


Where $\mu\_{\text{calculated}}$ is calculated assuming a 100% ionic bond.


For more details please see [this page](http://wwwchem.uwimona.edu.jm/courses/CHEM1902/IC10K_MG_Fajans.html).


 12

$$\text{% of ionic character} = 16\times ∆\mathrm{EN} + 3.5\times (∆\mathrm{EN})^2$$


where $∆\mathrm{EN}$ is electronegativity difference. For example, in $\ce{H-F}$ $∆\mathrm{EN} = 2$:


$$
\begin{align}
\text{% of ionic character} &= 16\times 2 + 3.5\times 2^2 \\
 &= 32 + 14 \\
 &= 46~(\%)
\end{align}
$$


 3

Linus Pauling has introduced the idea of defining the percent ionic character possessed by a chemical bond. A covalent bond with equal sharing of the charge density has 0% ionic character, while a perfect ionic bond would have 100% ionic
character. The ionic character of a bond increases with the difference in electronegativity between the cation and the anion. He has established a quantitative ionicity scale for molecules and crystals based on electronegativity difference (Ref.1 & 2):
$$I\_{ionicity} = 1 - e^{-\frac14(\chi\_A - \chi\_B)^2}$$
where $\chi\_A$ and $\chi\_B$ are electronegativities of atoms $\ce{A}$ and $\ce{B}$, respectively of the diatomic molecule $\ce{A-B}$. I have found the correct representation of the equation in Ref. 2 (hopefully) to avoid the confusion raised by two different answers within this question (I do not have access to Ref.1 to confirm the original equation). Following is the relation ship between some diatomic molecules:


[![Ionic Character of molecules](https://i.stack.imgur.com/HAaZj.jpg)](https://i.stack.imgur.com/HAaZj.jpg)


**References:**


1. Linus Pauling, In *The Nature of the Chemical Bonds and the Structure of Molecules and Crystals: An Introduction to Modern Structural Chemistry*; Third Edition; Cornell University Press: Ithaca, NY, 1960 (ISBN-10: 0-8014-0333-2).
2. P. Ramakrishnan, "Electronegativity: A Force or Energy," *International Journal of Trend in Scientific Research and Development* **2019**, *3(4)*, 665-685 (Unique Paper ID: IJTSRD23864; ISSN: 2456-6470).


 2

Electro negativity decides how the bond A-B is polarized- electron cloud is more attracted towards more electronegative atom. It's assumed that polarization beyond a certain limit, leads to ionic bond. The electronegativity difference serves as a measure of percentage at which a bond is ionic.Roughly speaking, electro negativity difference of 1.7 is equivalent to 50 ℅ ionic character;.(calculated ionic character in your question ) Thus, ionic character of a given compound is 50% ×∆ (E.N)/1.7


 0

I agree on most of Yomen Atassi's answer, however I would like to "correct/clarify" the formula of the percent ionic character. The following is the one cited by him, which is the one also reported in several sites in the internet:


Percent ionic character = (1 − e^(−(Δχ/2)2))×100


However applying this equation to real cases results in incoherent percentages (negative values larger than 100).
Checking the source of Pauling's equation (Pauling L. The nature of the chemical bond. 3rd ed. 1960. Pag. 98), I realized that the mathematical expression is different. This is the one cited in the book:


Percent ionic character = (1 − e^(−1/4(Δχ^2)))×100


The last expression provides consistent values which are in agreement with values reported by Pauling and other authors.  

If you want to apply Pauling's equation for the calculation of "percent of ionic character" (using electronegativity differences, Δχ), consider to use the later equation.


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