Valence-shell electron-pair repulsion predictions

Section 1 10 The shapes of molecules can often be predicted on the basis of valence shell electron pair repulsions A tetrahedral arrangement gives the max imum separation of four electron pairs (left) a trigonal planar arrange ment is best for three electron pairs (center) and a linear arrangement for two electron pairs (right)... 

Valence shell electron pair repulsion (VSEPR) model (Section 110) Method for predicting the shape of a molecule based on the notion that electron pairs surrounding a central atom repel one another Four electron pairs will arrange them selves in a tetrahedral geometry three will assume a trigo nal planar geometry and two electron pairs will adopt a linear arrangement... 

The major features of molecular geometry can be predicted on the basis of a quite simple principle—electron-pair repulsion. This principle is the essence of the valence-shell electron-pair repulsion (VSEPR) model, first suggested by N. V. Sidgwick and H. M. Powell in 1940. It was developed and expanded later by R. J. Gillespie and R. S. Nyholm. According to the VSEPR model, the valence electron pairs surrounding an atom repel one another. Consequently, the orbitals containing those electron pairs are oriented to be as far apart as possible. 

VSEPR model Valence Shell Electron Pair Repulsion model, used to predict molecular geometry states that electron pairs around a central atom tend to be as far apart as possible, 180-182... 

Example the n = 2 shell of Period 2 atoms, valence-shell electron-pair repulsion model (VSEPR model) A model for predicting the shapes of molecules, using the fact that electron pairs repel one another. 

Now that we know how to determine hybridization states, we need to know the geometry of each of the three hybridization states. One simple theory explains it all. This theory is called the valence shell electron pair repulsion theory (VSEPR). Stated simply, all orbitals containing electrons in the outermost shell (the valence shell) want to get as far apart from each other as possible. This one simple idea is all you need to predict the geometry around an atom. First, let s apply the theory to the three types of hybridized orbitals. 

Valence The highest-energy electrons in an atom, which an atom loses, gains, or shares in forming a chemical bond. Valence shell electron-pair repulsion (VSEPR) A procedure based on electron repulsion in molecules that enables chemists to predict approximate bond angles. 

In one respect the valence shell electron-pair repulsion theory is no better (and no worse) than other theories of molecular structure. Predictions can only be made when the constitution is known, i.e. when it is already known which and how many atoms are joined... 

The shape of a molecule has quite a bit to do with its reactivity. This is especially true in biochemical processes, where slight changes in shape in three-dimensional space might make a certain molecule inactive or cause an adverse side effect. One way to predict the shape of molecules is the valence-shell electron-pair repulsion (VSEPR) theory. The... 

VSEPR theory The VSEPR (valence shell electron-pair repulsion) theory says that the electron pairs around a central atom will try to get as far as possible from each other in order to minimize the repulsive forces. This theory is used to predict molecular geometry. 

VSEPR Model valence shell electron pair repulsion model, model used to predict the geometry of molecule based on distribution of shared and unshared electron pairs distributed around central atom of a molecule... 

We ll start with the hard part VSEPR stands for valence shell electron pair repulsion. Okay, now it gets easier. VSEPR is simply a model that helps predict and explain why molecules have the shapes they do. Moleculcir shapes help determine how molecules interact with each other. For example, molecules that stack nicely on one another are more likely to form solids. And two molecules that can fit together so their reactive bits lie closer together in space are more likely to react with one another. 

In this chapter a few simple rules for predicting molecular structures will be investigated. We shall examine first the valence shell electron pair repulsion (VSEPR) model, and then a purely molecular orbital treatment. 

The molecular structures adopted by simple carbonyl complexes are generally compatible with predictions based on valence shell electron pair repulsion theory. Three representative examples from the first transition series are shown in Fig. 15.2. 

The most useful approach in predicting the stereochemistry of coordination compounds is the Valence Shell Electron Pair Repulsion theory (VSEPR theory), which is based on the idea that the electron pairs around an atom will be arranged so as to minimize the repulsion between them. The qualitative foundations of this field were laid by Sidgwick and Powell1 in 1940 and by Gillespie... 

Like so many other molecular properties, shape is determined by the electronic structure of the bonded atoms. The approximate shape of a molecule can often be predicted by using what is called the valence-shell electron-pair repulsion (VSEPR) model. Electrons in bonds and in lone pairs can be thought of as "charge clouds" that repel one another and stay as far apart as possible, thus causing molecules to assume specific shapes. There are only two steps to remember in applying the VSEPR method ... 

The Laplacian of the electron density plays a dominant role throughout the theory.191 In addition, Bader has shown that the topology of the Laplacian recovers the Lewis model of the electron pair, a model that is not evident in the topology of the electron density itself. The Laplacian of the density thus provides a physical valence-shell electron pair repulsion (VSEPR) basis for the model of molecular geometry and for the prediction of the reaction sites and their relative alignment in acid-base reactions. This work is closely tied to earlier studies by Bader of the electron pair density, demonstrating that the spatial localization of electrons is a result of a corresponding localization of the Fermi correlation hole. 

Valence-shell electron pair repulsion (VSEPR) theory gives reasonably accurate predictions of bond angles in a molecule. VSEPR theory uses a simple electrostatic model in which groups of electrons around a central atom repel one another and occupy positions as far apart as possible. The number of electron groups, called the steric... 

A recent electron diffraction study has shown that the structure is consistent with those predicted by the Valence Shell Electron Pair Repulsion Theory (137). 

Starting with the Lewis structure, it is possible to predict fairly accurately the bond angles in a molecule. The VSEPR method (Valence Shell Electron Pair Repulsion) focuses on a central atom and counts the number... 

Atoms are bound into molecules by shared pairs of electrons. Electrons dislike each other because like charges repel each other. Therefore, whether they are lone pairs of electrons or bonding pairs of electrons, electron pairs try to get as far apart in space as is geometrically possible. There is a fancy name that summarizes these simple ideas the VSEPR theory, which stands for Valence Shell Electron Pair Repulsion Theory. Even though the VSEPR theory is founded on fundamentally simple ideas, it is a tremendously powerful tool for predicting the shapes of molecules. 

The valence shell electron pair repulsion theory states the all electrons in a molecule mutually repel each other and achieve a geometry so that the bonding pairs and lone pairs of electrons are as far apart in space as possible. This theory allows one to predict the shape and geometry of a molecule. 

The shapes of molecules are determined by actual experiments, not by theoretical considerations. But we do not want to have to memorize the shape of each molecule. Instead, we would like to be able to look at a Lewis structure and predict the shape of the molecule. Several models enable us to do this. One of the easiest to use is valence shell electron pair repulsion theory, which is often referred to by its acronym VSEPR (pronounced vesper ). As the name implies, the theory states that pairs of electrons in the valence shell repel each other and try to stay as far apart as possible. You probably remember this theory from your general chemistry class. The parts of VSEPR theory that... 

If an attempt were made to apply the rules of valence shell electron pair repulsion theory to radicals, it would not be clear how to treat the single electron. Obviously, a single electron should not be as large as a pair of electrons, but it is expected to result in some repulsion. Therefore, it is difficult to predict whether a radical carbon should be sp2 hybridized with trigonal planar geometry (with the odd electron in a p orbital), sp3 hybridized with tetrahedral geometry (with the odd electron in an sp3 AO), or somewhere in between. Experimental evidence is also somewhat uncertain. Studies of the geometry of simple alkyl radicals indicate that either they are planar or, if they are pyramidal, inversion is very rapid. 

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