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The bond dissociation energy (enthalpy) [4] is also referred to as bond disruption energy, bond energy, bond strength, or binding energy (abbreviation: BDE, BE, or D). It is defined as the standard enthalpy change of the following fission: R—X → R + X. The BDE, denoted by Dº(R—X), is usually derived by the thermochemical equation,
A force field is used to minimize the bond stretching energy of this ethane molecule. Molecular mechanics uses classical mechanics to model molecular systems. The Born–Oppenheimer approximation is assumed valid and the potential energy of all systems is calculated as a function of the nuclear coordinates using force fields. Molecular ...
Bond cleavage is also possible by a process called heterolysis. The energy involved in this process is called bond dissociation energy (BDE). [2] BDE is defined as the "enthalpy (per mole) required to break a given bond of some specific molecular entity by homolysis," symbolized as D. [3]
Bond energies and bond-dissociation energies are typically in the range of a few eV per bond. The bond-dissociation energy of a carbon-carbon bond is about 3.6 eV. Molecular level: Electron binding energy; Ionization energy Electron binding energy, more commonly known as ionization energy, [3] is a measure of the energy required to free an ...
Pauling obtained the first equation by noting that a bond can be approximately represented as a quantum mechanical superposition of a covalent bond and two ionic bond-states. The covalent energy of a bond is approximate, by quantum mechanical calculations, the geometric mean of the two energies of covalent bonds of the same molecules, and there ...
The term bond-dissociation energy is similar to the related notion of bond-dissociation enthalpy (or bond enthalpy), which is sometimes used interchangeably.However, some authors make the distinction that the bond-dissociation energy (D 0) refers to the enthalpy change at 0 K, while the term bond-dissociation enthalpy is used for the enthalpy change at 298 K (unambiguously denoted DH° 298).
Ionic bonds have high bond energy. Bond energy is the mean amount of energy required to break the bond in the gaseous state. Most ionic compounds exist in the form of a crystal structure, in which the ions occupy the corners of the crystal. Such a structure is called a crystal lattice.
Bonding energies are significant, with solution-phase values falling within the same order of magnitude as hydrogen bonds and salt bridges. Similar to these other non-covalent bonds, cation–π interactions play an important role in nature, particularly in protein structure, molecular recognition and enzyme catalysis. The effect has also been ...