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  2. Pi bond - Wikipedia

    en.wikipedia.org/wiki/Pi_bond

    A typical triple bond, for example in acetylene (HC≡CH), consists of one sigma bond and two pi bonds in two mutually perpendicular planes containing the bond axis. Two pi bonds are the maximum that can exist between a given pair of atoms. Quadruple bonds are extremely rare and can be formed only between transition metal atoms, and consist of ...

  3. Localized molecular orbitals - Wikipedia

    en.wikipedia.org/wiki/Localized_molecular_orbitals

    Localized molecular orbitals are molecular orbitals which are concentrated in a limited spatial region of a molecule, such as a specific bond or lone pair on a specific atom. They can be used to relate molecular orbital calculations to simple bonding theories, and also to speed up post-Hartree–Fock electronic structure calculations by taking ...

  4. Single bond - Wikipedia

    en.wikipedia.org/wiki/Single_bond

    The structure of pi bonds does not allow for rotation (at least not at 298 K), so the double bond and the triple bond which contain pi bonds are held due to this property. The sigma bond is not so restrictive, and the single bond is able to rotate using the sigma bond as the axis of rotation (Moore, Stanitski, and Jurs 396-397).

  5. Rotamer - Wikipedia

    en.wikipedia.org/wiki/Rotamer

    [2] [3] [4] The ring-flip of substituted cyclohexanes constitutes a common form of conformers. [5] The study of the energetics of bond rotation is referred to as conformational analysis. [6] In some cases, conformational analysis can be used to predict and explain product selectivity, mechanisms, and rates of reactions. [7]

  6. Molecular electronic transition - Wikipedia

    en.wikipedia.org/wiki/Molecular_electronic...

    Auxochromes with free electron pairs (denoted as "n") have their own transitions, as do aromatic pi bond transitions. Sections of molecules which can undergo such detectable electron transitions can be referred to as chromophores , since such transitions absorb electromagnetic radiation (light), which may be hypothetically perceived as color ...

  7. Molecular geometry - Wikipedia

    en.wikipedia.org/wiki/Molecular_geometry

    Molecular geometries can be specified in terms of 'bond lengths', 'bond angles' and 'torsional angles'. The bond length is defined to be the average distance between the nuclei of two atoms bonded together in any given molecule. A bond angle is the angle formed between three atoms across at least two bonds.

  8. Electrocyclic reaction - Wikipedia

    en.wikipedia.org/wiki/Electrocyclic_reaction

    In organic chemistry, an electrocyclic reaction is a type of pericyclic, rearrangement reaction where the net result is one pi bond being converted into one sigma bond or vice versa. [1] These reactions are usually categorized by the following criteria: Reactions can be either photochemical or thermal.

  9. NMR line broadening techniques - Wikipedia

    en.wikipedia.org/wiki/NMR_line_broadening_techniques

    If the bond rotates slowly enough compared to the NMR time scale (e.g., amide bond), two different species can be detected by the NMR spectrometer. Considering that the time scale of NMR spectroscopy is about a few seconds, this technique can be used to examine the kinetics and/or thermodynamics of chemical exchange reactions on the order of ...