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Analyze Cubic Unit Cell Geometry for Binary Compound

The cubic unit cell structure of a binary compound containing cation M and anion X is depicted below. Given that the cation has a smaller ionic radius compared to the anion, choose the correct statement(s).

Question Diagram 1

Options

A

The empirical formula of the given compound is MX\text{MX}.

Correct
B

The cation M and anion X possess distinct coordination geometries.

Correct
C

The ratio of the M-X bond length to the cubic unit cell edge length equals 0.8660.866.

D

The ratio of the ionic radius of cation M to anion X is 0.4140.414.

Topics & Concepts

Step-by-Step Solution

To determine the correct statement(s), we analyze the given cubic unit cell structure of the binary compound step-by-step:

1. Determination of the Empirical Formula (Option A)

  • Position of Cations (M\text{M}): The cations (M\text{M}, represented by solid black circles) are located at the midpoints of the 4 vertical edges of the unit cell. Since each edge center is shared equally among 4 adjacent unit cells: Number of M ions per unit cell=4×14=1\text{Number of M ions per unit cell} = 4 \times \frac{1}{4} = 1

  • Position of Anions (X\text{X}): The anions (X\text{X}, represented by open circles) are located at the midpoints of 4 horizontal edges (2 on the top face and 2 on the bottom face). Since each edge center is shared equally among 4 adjacent unit cells: Number of X ions per unit cell=4×14=1\text{Number of X ions per unit cell} = 4 \times \frac{1}{4} = 1

  • Empirical Formula: The stoichiometric ratio of M:X=1:1\text{M} : \text{X} = 1 : 1. Therefore, the empirical formula of the compound is MX\text{MX}.

Hence, Option (A) is correct.


2. Analysis of Coordination Geometries (Option B)

Let the cubic unit cell have edge length aa with a corner at the origin (0,0,0)(0,0,0).

  • Coordination Geometry of Cation M: Consider a cation M\text{M} located at the vertical edge center (0,0,a/2)(0, 0, a/2). Its four nearest neighbor X\text{X} anions are located at: (0,a2,0),(0,−a2,0),(a2,0,a),(−a2,0,a)\left(0, \frac{a}{2}, 0\right), \quad \left(0, -\frac{a}{2}, 0\right), \quad \left(\frac{a}{2}, 0, a\right), \quad \left(-\frac{a}{2}, 0, a\right) Two of these neighbors lie in the yzyz-plane at z=0z=0, and the other two lie in the xzxz-plane at z=az=a. These four neighbors form a tetrahedral geometry around cation M\text{M}.

  • Coordination Geometry of Anion X: Consider an anion X\text{X} located at the top-edge center (a2,0,a)\left(\frac{a}{2}, 0, a\right). Its four nearest neighbor M\text{M} cations are located at: (0,0,a2),(a,0,a2),(0,0,3a2),(a,0,3a2)\left(0, 0, \frac{a}{2}\right), \quad \left(a, 0, \frac{a}{2}\right), \quad \left(0, 0, \frac{3a}{2}\right), \quad \left(a, 0, \frac{3a}{2}\right) All four neighboring cations lie entirely in the single plane y=0y = 0, forming a square planar geometry around anion X\text{X}.

Since cation M\text{M} has tetrahedral coordination geometry while anion X\text{X} has square planar coordination geometry, they possess distinct coordination geometries.

Hence, Option (B) is correct.


3. Ratio of M-X Bond Length to Edge Length (Option C)

The bond length between cation M\text{M} at (0,0,a/2)(0, 0, a/2) and anion X\text{X} at (a2,0,a)\left(\frac{a}{2}, 0, a\right) is given by the distance formula: dM-X=(a2−0)2+(0−0)2+(a−a2)2=a24+a24=a2d_{\text{M-X}} = \sqrt{\left(\frac{a}{2} - 0\right)^2 + (0 - 0)^2 + \left(a - \frac{a}{2}\right)^2} = \sqrt{\frac{a^2}{4} + \frac{a^2}{4}} = \frac{a}{\sqrt{2}}

Thus, the ratio of the M-X\text{M-X} bond length to the unit cell edge length aa is: dM-Xa=12≈0.707\frac{d_{\text{M-X}}}{a} = \frac{1}{\sqrt{2}} \approx 0.707

Since 12≈0.707≠0.866\frac{1}{\sqrt{2}} \approx 0.707 \neq 0.866 (where 0.866=320.866 = \frac{\sqrt{3}}{2}), Option (C) is incorrect.

Hence, Option (C) is incorrect.


4. Ratio of Ionic Radii (Option D)

For the cation M\text{M}, which occupies a site with tetrahedral coordination (coordination number 4), the ideal limiting radius ratio rM/rXr_{\text{M}} / r_{\text{X}} for structural stability is: rMrX=32−1≈0.225\frac{r_{\text{M}}}{r_{\text{X}}} = \sqrt{\frac{3}{2}} - 1 \approx 0.225

The value 0.4140.414 corresponds to octahedral or square planar coordination.

Hence, Option (D) is incorrect.


Conclusion

The correct statements are A and B.