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Valence shell electron pair repulsion (VSEPR) theory (/ ˈ v ɛ s p ər, v ə ˈ s ɛ p ər / VESP-ər, [1]: 410 və-SEP-ər [2]) is a model used in chemistry to predict the geometry of individual molecules from the number of electron pairs surrounding their central atoms. [3]
Molecular geometry is the three-dimensional arrangement of the atoms that constitute a molecule. It includes the general shape of the molecule as well as bond lengths , bond angles , torsional angles and any other geometrical parameters that determine the position of each atom.
In some important cases (topological index calculation etc.) the following classical definition is sufficient: a molecular graph is a connected, undirected graph which admits a one-to-one correspondence with the structural formula of a chemical compound in which the vertices of the graph correspond to atoms of the molecule and edges of the ...
Both these studies show how Bent's rule can be used to aid synthetic chemistry. Knowing how molecular geometry accurately due to Bent's rule allows synthetic chemists to predict relative product stability. [14] [30] Additionally, Bent's rule can help chemists choose their starting materials to drive the reaction towards a particular product. [14]
Phosphorus pentoxide chemical structure in 2D. A chemical structure of a molecule is a spatial arrangement of its atoms and their chemical bonds. Its determination includes a chemist's specifying the molecular geometry and, when feasible and necessary, the electronic structure of the target molecule or other solid.
Molecular graphics is the discipline and philosophy of studying molecules and their properties through graphical representation. [1] IUPAC limits the definition to representations on a "graphical display device". [ 2 ]
In contrast to the sigma 1s MO's, the σ 2p has some non-bonding electron density at either side of the nuclei and the σ* 2p has some electron density between the nuclei. The other two p-orbitals, p y and p x, can overlap side-on. The resulting bonding orbital has its electron density in the shape of two lobes above and below the plane of the ...
The molecular configuration of a molecule is the permanent geometry that results from the spatial arrangement of its bonds. [1] The ability of the same set of atoms to form two or more molecules with different configurations is stereoisomerism. This is distinct from constitutional isomerism which arises from atoms being connected in a different ...