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Ch.12 - Solids and Modern Materials
Chapter 12, Problem 51c

The molecular-orbital diagrams for two- and four-atom linear chains of lithium atoms are shown in Figure 12.22. Construct a molecular-orbital diagram for a chain containing six lithium atoms and use it to answer the following questions: (c) How many nodes are in the highest-energy molecular orbital?
Molecular orbital diagram for six lithium atoms showing energy levels and nodes.

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1
Identify the number of lithium atoms in the chain, which is six.
Recognize that each lithium atom contributes one valence electron, resulting in a total of six valence electrons for the chain.
Construct the molecular orbital diagram by arranging the molecular orbitals in order of increasing energy, as shown in the provided image.
Determine the highest-energy molecular orbital by locating the topmost orbital in the diagram.
Count the number of nodes (regions where the probability of finding an electron is zero) in this highest-energy molecular orbital.

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Key Concepts

Here are the essential concepts you must grasp in order to answer the question correctly.

Molecular Orbitals

Molecular orbitals (MOs) are formed by the linear combination of atomic orbitals (LCAO) when atoms bond together. In a molecular orbital diagram, these orbitals are depicted with their energy levels, showing how electrons are distributed among them. The number of MOs corresponds to the number of atomic orbitals combined, and they can be classified as bonding, antibonding, or non-bonding based on their energy and stability.
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Nodes in Molecular Orbitals

Nodes are regions in a molecular orbital where the probability of finding an electron is zero. The number of nodes in a molecular orbital is related to its energy level; specifically, the highest-energy molecular orbital will have the most nodes. For a linear chain of atoms, the number of nodes can be calculated using the formula: number of nodes = n - 1, where n is the number of atomic orbitals contributing to the molecular orbital.
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Energy Levels in Molecular Chains

In a molecular chain, the energy levels of molecular orbitals are influenced by the number of atoms in the chain. As more atoms are added, the energy levels become more closely spaced, leading to a greater number of available molecular orbitals. This affects the distribution of electrons and the overall stability of the molecule, as well as the characteristics of the highest-energy molecular orbital, which is crucial for understanding electronic transitions and reactivity.
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Related Practice
Textbook Question

State whether each sentence is true or false: (a) Metals have high electrical conductivities because the electrons in the metal are delocalized. (c) Metals have large thermal conductivities because they expand when heated. (d) Metals have small thermal conductivities because the delocalized electrons cannot easily transfer the kinetic energy imparted to the metal from heat.

Textbook Question

State whether each sentence is true or false: (b) Metals have high electrical conductivities because they are denser than other solids.

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Textbook Question

The molecular-orbital diagrams for two- and four-atom linear chains of lithium atoms are shown in Figure 12.22. Construct a molecular-orbital diagram for a chain containing six lithium atoms and use it to answer the following questions: (a) How many molecular orbitals are there in the diagram?

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Textbook Question

The molecular-orbital diagrams for two- and four-atom linear chains of lithium atoms are shown in Figure 12.22. Construct a molecular-orbital diagram for a chain containing six lithium atoms and use it to answer the following questions: (e) How many nodes are in the lowest-energy unoccupied molecular orbital (LUMO)?

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Textbook Question

Repeat Exercise 12.51 for a linear chain of eight lithium atoms. (b) How many nodes are in the lowest-energy molecular orbital? (c) How many nodes are in the highestenergy molecular orbital? (d) How many nodes are in the highest-energy occupied molecular orbital (HOMO)? (e) How many nodes are in the lowest-energy unoccupied molecular orbital (LUMO)?

Textbook Question

Repeat Exercise 12.51 for a linear chain of eight lithium atoms. (f) How does the HOMO–LUMO energy gap for this case compare to that of the four-atom case?

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