To determine the formula of a compound from its unit cell, one needs to know how many atoms are contained within the unit cell.

A simple cubic cell has an atom at each corner of a cube for a total of 8 atoms. However, the atoms are not inside the cube; in fact, only 1/8 of each atom is actually inside the cube.

So, there is only one atom inside the cube drawn on the right.


To count atoms in the unit cell, count up all the atoms at each position. Then multiply by the fraction that is inside the unit cell.

1/8 of an atom that is on a corner is inside the unit cell.

1/4 of an atom that is on an edge is inside the unit cell.

1/2 of an atom that is on a face is inside the unit cell.

Determine the formula of NaCl from the unit cell.

8 Cl- ions on corners

8 x 1/8 = 1 Cl-'s

6 Cl- ions on faces

6 x 1/2 = 3 Cl-'s

4 Cl-'s

12 x 1/4 = 3 Na+'s

1 Na+ ion in the center

1 Na+'s

12 Na+ ions on edges

4 Na+'s

Na4Cl4 or NaCl