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Three-center Four-electron Bond
The 3-center 4-electron (3c–4e) bond is a model used to explain bonding in certain hypervalent molecules such as tetratomic and hexatomic interhalogen compounds, sulfur tetrafluoride, the xenon fluorides, and the bifluoride ion. It is also known as the Pimentel–Rundle three-center model after the work published by George C. Pimentel in 1951,Pimentel, G. C. The Bonding of Trihalide and Bifluoride Ions by the Molecular Orbital Method. ''J. Chem. Phys.'' 1951, ''19'', 446-448. which built on concepts developed earlier by Robert E. Rundle for electron-deficient bonding.Rundle, R. E. Electron Deficient Compounds. II. Relative Energies of "Half-Bonds". ''J. Chem. Phys.'' 1949, ''17'', 671–675. An extended version of this model is used to describe the whole class of hypervalent molecules such as phosphorus pentafluoride and sulfur hexafluoride as well as multi-center π-bonding such as ozone and sulfur trioxide. There are also molecules such as diborane (B2H6) and dialane (Al2H6) ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Hypervalent Molecule
In chemistry, a hypervalent molecule (the phenomenon is sometimes colloquially known as expanded octet) is a molecule that contains one or more main group elements apparently bearing more than eight electrons in their valence shells. Phosphorus pentachloride (), sulfur hexafluoride (), chlorine trifluoride (), the chlorite () ion, and the triiodide () ion are examples of hypervalent molecules. Definitions and nomenclature Hypervalent molecules were first formally defined by Jeremy I. Musher in 1969 as molecules having central atoms of group 15–18 in any valence other than the lowest (i.e. 3, 2, 1, 0 for Groups 15, 16, 17, 18 respectively, based on the octet rule). Several specific classes of hypervalent molecules exist: * Hypervalent iodine compounds are useful reagents in organic chemistry (e.g. Dess–Martin periodinane) * Tetra-, penta- and hexavalent phosphorus, silicon, and sulfur compounds (e.g. PCl5, PF5, SF6, sulfuranes and persulfuranes) * Noble gas compounds (ex. xe ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Hypervalent Molecule
In chemistry, a hypervalent molecule (the phenomenon is sometimes colloquially known as expanded octet) is a molecule that contains one or more main group elements apparently bearing more than eight electrons in their valence shells. Phosphorus pentachloride (), sulfur hexafluoride (), chlorine trifluoride (), the chlorite () ion, and the triiodide () ion are examples of hypervalent molecules. Definitions and nomenclature Hypervalent molecules were first formally defined by Jeremy I. Musher in 1969 as molecules having central atoms of group 15–18 in any valence other than the lowest (i.e. 3, 2, 1, 0 for Groups 15, 16, 17, 18 respectively, based on the octet rule). Several specific classes of hypervalent molecules exist: * Hypervalent iodine compounds are useful reagents in organic chemistry (e.g. Dess–Martin periodinane) * Tetra-, penta- and hexavalent phosphorus, silicon, and sulfur compounds (e.g. PCl5, PF5, SF6, sulfuranes and persulfuranes) * Noble gas compounds (ex. xe ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Carboxylate
In organic chemistry, a carboxylate is the conjugate base of a carboxylic acid, (or ). It is an ion with negative charge. Carboxylate salts are salts that have the general formula , where M is a metal and ''n'' is 1, 2,...; ''carboxylate esters'' have the general formula (or ). R and R′ are organic groups; R′ ≠ H. Synthesis Carboxylate ions can be formed by deprotonation of carboxylic acids. Such acids typically have p''K''a of less than 5, meaning that they can be deprotonated by many bases, such as sodium hydroxide or sodium bicarbonate. :RCOOH + NaOH -> RCOONa + H2O Resonance stabilization of the carboxylate ion Carboxylic acids easily dissociate into a carboxylate anion and a positively charged hydrogen ion (proton), much more readily than alcohols do (into an alkoxide ion and a proton), because the carboxylate ion is stabilized by resonance. The negative charge that is left after deprotonation of the carboxyl group is delocalized between ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Hydrogen Bonding
In chemistry, a hydrogen bond (or H-bond) is a primarily electrostatic force of attraction between a hydrogen (H) atom which is covalently bound to a more electronegative "donor" atom or group (Dn), and another electronegative atom bearing a lone pair of electrons—the hydrogen bond acceptor (Ac). Such an interacting system is generally denoted , where the solid line denotes a polar covalent bond, and the dotted or dashed line indicates the hydrogen bond. The most frequent donor and acceptor atoms are the second-row elements nitrogen (N), oxygen (O), and fluorine (F). Hydrogen bonds can be intermolecular (occurring between separate molecules) or intramolecular (occurring among parts of the same molecule). The energy of a hydrogen bond depends on the geometry, the environment, and the nature of the specific donor and acceptor atoms and can vary between 1 and 40 kcal/mol. This makes them somewhat stronger than a van der Waals interaction, and weaker than fully covalent or ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Activated Complex
In chemistry an activated complex is defined by the International Union of Pure and Applied Chemistry (IUPAC) as "that assembly of atoms which corresponds to an arbitrary infinitesimally small region at or near the col (saddle point) of a potential energy surface". In other words, it refers to a collection of intermediate structures in a chemical reaction that persist while bonds are breaking and new bonds are forming. It therefore represents not one defined state, but rather a range of transient configurations that a collection of atoms passes through in between clearly defined products and reactants. It is the subject of transition state theory - also known as activated complex theory - which studies the kinetics of reactions that pass through a defined intermediate state with standard Gibbs energy of activation . The state represented by the double dagger symbol is known as the transition state and represents the exact configuration that has an equal probability of forming eith ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Transition State
In chemistry, the transition state of a chemical reaction is a particular configuration along the reaction coordinate. It is defined as the state corresponding to the highest potential energy along this reaction coordinate. It is often marked with the double dagger ‡ symbol. As an example, the transition state shown below occurs during the SN2 reaction of bromoethane with a hydroxide anion: The activated complex of a reaction can refer to either the transition state or to other states along the reaction coordinate between reactants and products, especially those close to the transition state.Peter Atkins and Julio de Paula, ''Physical Chemistry'' (8th ed., W.H. Freeman 2006), p.809 According to the transition state theory, once the reactants have passed through the transition state configuration, they always continue to form products. History of concept The concept of a transition state has been important in many theories of the rates at which chemical reactions occ ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
SN2 Reaction
The SN2 reaction is a type of reaction mechanism that is common in organic chemistry. In this mechanism, one bond is broken and one bond is formed in a concerted way, i.e., in one step. The name SN2 refers to the Hughes-Ingold symbol of the mechanism: "SN" indicates that the reaction is a nucleophilic substitution, and "2" that it proceeds via a bi-molecular mechanism, which means both the reacting species are involved in the rate-determining step. The other major type of nucleophilic substitution is the SN1, but many other more specialized mechanisms describe substitution reactions. The SN2 reaction can be considered as an analogue of the associative substitution in the field of inorganic chemistry. Reaction mechanism The reaction most often occurs at an aliphatic sp3 carbon center with an electronegative, stable leaving group attached to it (often denoted X), which is frequently a halide atom. The breaking of the C–X bond and the formation of the new bond (often deno ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Bifluoride
The bifluoride ion is an inorganic anion with the chemical formula . The anion is colorless. Salts of bifluoride are commonly encountered in the reactions of fluoride salts with hydrofluoric acid. The commercial production of fluorine involves electrolysis of bifluoride salts. Structure and bonding The bifluoride ion has a linear, centrosymmetric structure (''D∞h'' symmetry), with an F− H bond length of 114 pm. The bond strength is estimated to be greater than 155 kJ/mol. In molecular orbital theory, the atoms are modeled to be held together by a 3-center 4-electron bond.Pimentel, G. C. The Bonding of Trihalide and Bifluoride Ions by the Molecular Orbital Method. ''J. Chem. Phys.'' 1951, ''19'', 446-448. Reactions Salts, such as potassium bifluoride and ammonium bifluoride Ammonium hydrogen fluoride is the inorganic compound with the formula or . It is produced from ammonia and hydrogen fluoride. This colourless salt is a glass- etchant and an intermediate in ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Argon Fluorohydride
Argon fluorohydride (systematically named fluoridohydridoargon) or argon hydrofluoride is an inorganic compound with the chemical formula HArF (also written ArHF). It is a compound of the chemical element argon. Discovery The discovery of this argon compound is credited to a group of Finnish scientists, led by Markku Räsänen. On 24 August 2000, in the journal ''Nature'', they announced their discovery of argon fluorohydride. This discovery caused the recognition that argon could form weakly bound compounds, even though it was not the first. Synthesis This chemical was synthesized by mixing argon and hydrogen fluoride on a caesium iodide surface at 8 K (−265 °C), and exposing the mixture to ultraviolet radiation. This caused the gases to combine. The infrared spectrum of the resulting gas mixture shows that it definitely contains chemical bonds, albeit very weak ones; thus, it is argon fluorohydride, and not a supermolecule The term supermolecule (or supramolecule) ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Radon Difluoride
Radon difluoride () is a compound of radon, a radioactive noble gas. Radon reacts readily with fluorine to form a solid compound, but this decomposes on attempted vaporization and its exact composition is uncertain. Calculations suggest that it may be ionic, unlike all other known binary noble gas compounds. The usefulness of radon compounds is limited because of the radioactivity of radon. The longest-lived isotope, radon-222, has a half-life of only 3.82 days, which decays by α-emission to yield polonium-218. Preparation When radon is heated to 400 °C with fluorine, radon difluoride is formed. Reactions Radon difluoride can be reduced to radon and hydrogen fluoride when heated with hydrogen Hydrogen is the chemical element with the symbol H and atomic number 1. Hydrogen is the lightest element. At standard conditions hydrogen is a gas of diatomic molecules having the formula . It is colorless, odorless, tasteless, non-toxic, an ... gas at 500 °C. References ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Krypton Difluoride
Krypton difluoride, KrF2 is a chemical compound of krypton and fluorine. It was the first compound of krypton discovered. It is a volatile, colourless solid at room temperature. The structure of the KrF2 molecule is linear, with Kr−F distances of 188.9 pm. It reacts with strong Lewis acids to form salts of the KrF+ and Kr cations. The atomization energy of KrF2 (KrF2(g) → Kr(g) + 2F(g)) is 21.9 kcal/mol, giving an average Kr–F bond energy of only 11 kcal/mol, the weakest of any isolable fluoride. In comparison, difluorine is held together by a bond of 36 kcal/mol. Consequently, KrF2 is a good source of the extremely reactive and oxidizing atomic fluorine. It is thermally unstable, with a decomposition rate of 10% per hour at room temperature. Krypton difluoride is endothermic, with a heat of formation of 14.4 ± 0.8 kcal/mol measured at 93 °C. Synthesis Krypton difluoride can be synthesized using many different methods including electrical discharge, photoionizat ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Xenon Difluoride
Xenon difluoride is a powerful fluorinating agent with the chemical formula , and one of the most stable xenon compounds. Like most covalent inorganic fluorides it is moisture-sensitive. It decomposes on contact with water vapor, but is otherwise stable in storage. Xenon difluoride is a dense, colourless crystalline solid. It has a nauseating odour and low vapor pressure. Structure Xenon difluoride is a linear molecule with an Xe–F bond length of in the vapor stage, and 200 pm in the solid phase. The packing arrangement in solid shows that the fluorine atoms of neighbouring molecules avoid the equatorial region of each molecule. This agrees with the prediction of VSEPR theory, which predicts that there are 3 pairs of non-bonding electrons around the equatorial region of the xenon atom. At high pressures, novel, non-molecular forms of xenon difluoride can be obtained. Under a pressure of ~50 GPa Grading in education is the process of applying standardized ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
