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  2. Orbital overlap - Wikipedia

    en.wikipedia.org/wiki/Orbital_overlap

    In chemical bonds, an orbital overlap is the concentration of orbitals on adjacent atoms in the same regions of space. Orbital overlap can lead to bond formation. The general principle for orbital overlap is that, the greater the greater the over between orbitals, the greater is the bond strength.

  3. Molecular orbital theory - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital_theory

    Atomic orbitals must also overlap within space. They cannot combine to form molecular orbitals if they are too far away from one another. Atomic orbitals must be at similar energy levels to combine as molecular orbitals. Because if the energy difference is great, when the molecular orbitals form, the change in energy becomes small.

  4. Atomic orbital - Wikipedia

    en.wikipedia.org/wiki/Atomic_orbital

    The first dictates that no two electrons in an atom may have the same set of values of quantum numbers (this is the Pauli exclusion principle). These quantum numbers include the three that define orbitals, as well as the spin magnetic quantum number m s. Thus, two electrons may occupy a single orbital, so long as they have different values of m s.

  5. Molecular orbital - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital

    In hydrogen fluoride HF overlap between the H 1s and F 2s orbitals is allowed by symmetry but the difference in energy between the two atomic orbitals prevents them from interacting to create a molecular orbital. Overlap between the H 1s and F 2p z orbitals is also symmetry allowed, and these two atomic orbitals have a small energy separation ...

  6. Molecular orbital diagram - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital_diagram

    The superposition of the two 1s atomic orbitals leads to the formation of the σ and σ* molecular orbitals. Two atomic orbitals in phase create a larger electron density, which leads to the σ orbital. If the two 1s orbitals are not in phase, a node between them causes a jump in energy, the σ* orbital.

  7. Valence bond theory - Wikipedia

    en.wikipedia.org/wiki/Valence_bond_theory

    σ bond between two atoms: localization of electron density Two p-orbitals forming a π-bond. The overlapping atomic orbitals can differ. The two types of overlapping orbitals are sigma and pi. Sigma bonds occur when the orbitals of two shared electrons overlap head-to-head, with the electron density most concentrated between nuclei.

  8. Hückel method - Wikipedia

    en.wikipedia.org/wiki/Hückel_method

    To summarize, we are assuming that: (1) the energy of an electron in an isolated C(2p z) orbital is =; (2) the energy of interaction between C(2p z) orbitals on adjacent carbons i and j (i.e., i and j are connected by a σ-bond) is =; (3) orbitals on carbons not joined in this way are assumed not to interact, so = for nonadjacent i and j; and ...

  9. Unpaired electron - Wikipedia

    en.wikipedia.org/wiki/Unpaired_electron

    These orbitals are strongly directional and therefore overlap to form strong covalent bonds, favouring dimerisation of radicals. Radicals can be stable if dimerisation would result in a weak bond or the unpaired electrons are stabilised by delocalisation. In contrast, radicals in d- and f-block chemistry are very common.