Calculating K Using Non-equilibrium Values

All the examples to this point have been relatively easy because we knew the concentration of every substance in the K expression, at equilibrium.

In earlier questions, we developed the following principle:

To calculate the value of K:
Step 1: Write out the K expression for the balanced equation
Step 2: Identify each concentration at equilibrium
Step 3: Substitute into K and do the math

Previous examples were relatively easy because step 2 didn't really need any work – we always were given each concentration at equilibrium.  In the examples on this page we will not have all the concentrations at equilibrium, but each problem will have enough information to get to that point, so that we can then calculate Keq.

To do this, we need to make use of the balanced chemical equation, and what we know about the coefficients in the reaction.  Remember that the coefficients tell us the ratio in which the reactants react, and the products are formed, but not how much there is of any substance at equilibrium (nor at the start of the reaction).  In general we always have, or can figure out, three pieces of information about any chemical reaction:

To keep track of these it is really useful to make up an "IRE" table and complete it with the information we have available about the intitial, reaction change, and equilibrium concentrations.   Here is an example of an empty table:

Provided that we know the inital (white row) value of each reactant or product, and at least one equilibrium value (pink row), we can complete this table to get all the pink values.  Here is an example of how we do this.

Example 1:  0.118 mol of N2 and 0.645 mol of H2 gases are placed in a 1.00 L flask and heated to 400 șC.  After equilibrium has been reached the concentration of NH3 (g) is 3.50 x 10-2 mol/L.  What is K?
Hold it! Isn't there an obvious problem here?   Shouldn't the ratio of N2 to H2 be 1:3 according to the balanced equation?  If [N2] = 0.118, then shouldn't [H2] = 0.354?  Make sure you know the right answer before going on.

Step 1: Write out the K expression for the balanced equation

From the way the problem is stated, this reaction is N2 (g) + 3H2 (g) 2NH3 (g) for which 

Step 2: Identify each concentration at equilibrium.  To do this we set up and complete the IRE table.  This gives equilibrium concentrations of:
  • [N2] = 0.100 mol/L
  • [H2] = 0.592 mol/L
  • [NH3] = 3.50x10-2 mol/L

Click for an explationClick here for a step by step explanation of how to use an IRE table to solve this problem.

Step 3: Substitute these values for equilibrium into K, do the math, and round off to the correct significant digits.

 

Example 2:  0.100 mol of HI, 0.200 mol of I2 and 0.300 mol of H2 gases are placed in a 1.00 L flask and heated to 425 șC.  After equilibrium has been reached the concentration of H2 (g) is 0.141 mol/L.  What is K?
Can you actually do this?  Start a reaction with products in the container?  Make sure you know the right answer before going on.

Step 1: Write out the K expression for the balanced equation:

From the way this problem is stated, the reaction could be either

or 2HI (g) I2 (g) + H2 (g) (1)
I2 (g) + H2 (g) 2HI (g) (2)

It really doesn't matter which one you pick, but you must include the reaction with the K expression, since the two equations will have K values that are reciprocals of each other.  Let's use version (2) for which 

Step 2: Identify each concentration at equilibrium.  To do this we set up and complete the IRE table.  This gives equilibrium concentrations of:
  • [I2] = 0.0141 mol/L
  • [H2] = 0.141 mol/L
  • [HI] = 0.418  mol/L

A completed IRE table for this reaction

Click for an explationClick here for a step by step explanation of how to use an IRE table to solve this problem.

Step 3: Substitute these values for equilibrium into K and do the math

Summary:

Use an IRE table whenever you don't know all the concentrations at equilibrium.

Sample problems Try the following sample problems to check your understanding.