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The bond angle for water is 104.5°. Valence shell electron pair repulsion (VSEPR) theory (/ ˈvɛspər, vəˈsɛpər / VESP-ər, [ 1 ]: 410və-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 ] It is also named the Gillespie-Nyholm ...
Steric effects arise from the spatial arrangement of atoms. When atoms come close together there is generally a rise in the energy of the molecule. Steric effects are nonbonding interactions that influence the shape (conformation) and reactivity of ions and molecules. Steric effects complement electronic effects, which dictate the shape and ...
The Taft equation is a linear free energy relationship (LFER) used in physical organic chemistry in the study of reaction mechanisms and in the development of quantitative structure–activity relationships for organic compounds. It was developed by Robert W. Taft in 1952 [2][3][4] as a modification to the Hammett equation. [5]
Sulfur dioxide is the product of the burning of sulfur or of burning materials that contain sulfur: S8 + 8 O2 → 8 SO2, ΔH = −297 kJ/mol. To aid combustion, liquified sulfur (140–150 °C (284–302 °F) is sprayed through an atomizing nozzle to generate fine drops of sulfur with a large surface area.
All three angles are at 180° in the conformation shown. In biochemistry, a Ramachandran plot (also known as a Rama plot, a Ramachandran diagram or a [φ,ψ] plot), originally developed in 1963 by G. N. Ramachandran, C. Ramakrishnan, and V. Sasisekharan, [1] is a way to visualize energetically allowed regions for backbone dihedral angles ψ ...
Sterimol parameters are built upon the Corey-Pauling-Koltun atomic models, which take into consideration the Van der Waals radii of each atom in the molecule. Unlike most other steric parameters such as A-value, Taft parameters and Tolman cone angle, which group all the spatial information into a single cumulative value, Sterimol parameters consist of three sub-parameters: one length parameter ...
A lone pair of electrons resides on the sulfur atom, giving it tetrahedral electron-pair geometry and trigonal pyramidal shape (steric number 4 with one lone pair; see VSEPR theory). When the two organic residues are dissimilar, the sulfur atom is a chiral center, for example, in methyl phenyl sulfoxide.
In biochemistry and pharmacology, the Hill equation refers to two closely related equations that reflect the binding of ligands to macromolecules, as a function of the ligand concentration. A ligand is "a substance that forms a complex with a biomolecule to serve a biological purpose" (ligand definition), and a macromolecule is a very large ...