Molecular orbitals of water
[DOCX File]Chapter 01 - Covalent Bonding and Shapes of Molecules
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10.6 Molecular Orbital Theory . Molecular Orbitals : Covalent bonds resulting from interaction of the atomic orbitals of the bonding atoms and are associated with the entire molecule. Bonding and Antibonding Molecular Orbitals. Bonding Molecular Orbital : Has lower energy and greater stability than the atomic orbitals from which it was formed.
[DOC File]SECTION P: MOLECULAR GEOMETRY
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Excersise: Calculate the molecular orbitals for water. What do you anticipate the orbitals to look like? Two lone pairs on the oxygen atom, responsible for the hydrogen bonds in liquid water? Answer: Look and see for yourself. The truth is that molecular orbitals are not unique. The only thing that matters is the Slater determinant they create.
[DOC File]INTRODUCTION TO MOLECULAR ORBITAL THEORY
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(H-Ö-H Oxygen in water has 2 bonding & 2 non-bonding electron pairs) All electron pairs (both bonding & non-bonding) repel each other & occupy molecular orbitals (MO) located as far apart as possible. 5. Formation of double bonds do not affect the geometry. Major …
[DOC File]Lect 12 3D Molecular Structure
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The fact that H2O has a dipole moment suggests that the water molecule is . Use each response in a separate question. ... Explain in terms of the hybrid orbitals involved. NH3 (pyramidal geometry) reacts with BF3 (planar geometry) to form the addition compound, H3NBF3. ... The molecular structure of BrF5 is (A) square pyramidal. (C) trigonal ...
[DOC File]Chapter 10 Notes - Pace University
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10.8 Molecular Orbital Theory: Electron Delocalization. Know the basis for molecular orbital theory. Know and understand how linear combinations of atomic orbitals (LCAO) form molecular orbitals. Define . bonding orbital. and . antibonding orbital. and understand the differences between the two. Predict and draw molecular orbital diagrams.
[DOC File]Quantum Chemical calculations with Gaussian
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bonding molecular orbitals of ethene, H. 2. ... Provide a neatly drawn figure to show the atomic orbitals that overlap to form each of the bonds in water (H. 2. O) and which contain the lone pair of electrons. Label each orbital with its hybridization.
Student Objectives
Where is the energy difference (Between which orbitals) that corresponds to o (10Dq)? Label o on the MO diagram. What type of orbitals (bonding, non-bonding, antibonding) are the “crystal field” orbitals? Explain why. Calculate the o for [Co(NH3)6]3+, then determine if it is low- or high-spin. Fill in the MO diagram accordingly.
[DOC File]Molecular Orbital Theory of Octahedral Complexes
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Handout 10 – Atomic Orbitals. The first 3 S - orbitals. Shapes of the s, p, and d orbitals. The s and p orbitals around a single atom. Handout 11 – Aufbau Diagram. Handout 12 – Atomic Radii. Handout 13 – 1st Ionization Energy. Handout 14 – Successive Ionization Energies. Handout 15 – Electron Affinity . Handout 16 - Covalent Compounds
Introduction to Molecular Orbital Theory
In the step following construction of the molecular orbitals, we place the electrons into the molecular orbitals. The configuration [σ(1s)]2 follows. Molecular hydrogen has two electrons so the Pauli principle permits us to place both in the bonding molecular orbital but requires pairing of the electrons.
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