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Basics. Molecular orbital diagrams are diagrams of molecular orbital (MO) energy levels, shown as short horizontal lines in the center, flanked by constituent atomic orbital (AO) energy levels for comparison, with the energy levels increasing from the bottom to the top. Lines, often dashed diagonal lines, connect MO levels with their ...
Diagram of the HOMO and LUMO of a molecule. Each circle represents an electron in an orbital; when light of a high enough frequency is absorbed by an electron in the HOMO, it jumps to the LUMO. 3D model of the highest occupied molecular orbital in CO 2 3D model of the lowest unoccupied molecular orbital in CO 2
In chemistry, molecular orbital theory (MO theory or MOT) is a method for describing the electronic structure of molecules using quantum mechanics. It was proposed early in the 20th century. The MOT explains the paramagnetic nature of O 2, which VSEPR theory cannot explain. In molecular orbital theory, electrons in a molecule are not assigned ...
In chemistry, a molecular orbital (/ ɒrbədl /) is a mathematical function describing the location and wave-like behavior of an electron in a molecule. This function can be used to calculate chemical and physical properties such as the probability of finding an electron in any specific region.
Infobox references. The helium dimer is a van der Waals molecule with formula He 2 consisting of two helium atoms. [2] This chemical is the largest diatomic molecule —a molecule consisting of two atoms bonded together. The bond that holds this dimer together is so weak that it will break if the molecule rotates, or vibrates too much.
Neon compounds. Neon compounds are chemical compounds containing the element neon (Ne) with other molecules or elements from the periodic table. Compounds of the noble gas neon were believed not to exist, but there are now known to be molecular ions containing neon, as well as temporary excited neon-containing molecules called excimers.
Here the sum extends over π molecular orbitals only, and n i is the number of electrons occupying orbital i with coefficients c ri and c si on atoms r and s respectively. Assuming a bond order contribution of 1 from the sigma component this gives a total bond order (σ + π) of 5/3 = 1.67 for benzene, rather than the commonly cited bond order ...
Molecular orbital theory predicts the electronic ground state denoted by the molecular term symbol 3 Σ – g, and two low-lying excited singlet states with term symbols 1 Δ g and 1 Σ + g. These three electronic states differ only in the spin and the occupancy of oxygen's two antibonding π g-orbitals, which are degenerate (equal in energy).