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  2. Bond order - Wikipedia

    en.wikipedia.org/wiki/Bond_order

    In chemistry, bond order is a formal measure of the multiplicity of a covalent bond between two atoms. As introduced by Gerhard Herzberg, [1] building off of work by R. S. Mulliken and Friedrich Hund, bond order is defined as the difference between the numbers of electron pairs in bonding and antibonding molecular orbitals.

  3. Molecular orbital diagram - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital_diagram

    The σ from the 2p is more non-bonding due to mixing, and same with the 2s σ. This also causes a large jump in energy in the 2p σ* orbital. The bond order of diatomic nitrogen is three, and it is a diamagnetic molecule. [12] The bond order for dinitrogen (1σ g 2 1σ u 2 2σ g 2 2σ u 2 1π u 4 3σ g 2) is three because two electrons are now ...

  4. Triplet oxygen - Wikipedia

    en.wikipedia.org/wiki/Triplet_oxygen

    Under a molecular orbital theory framework, the oxygen-oxygen bond in triplet dioxygen is better described as one full σ bond plus two π half-bonds, each half-bond accounted for by two-center three-electron (2c-3e) bonding, to give a net bond order of two (1+2× ⁠ 1 / 2 ⁠), while also accounting for the spin state (S = 1).

  5. Oxidation state - Wikipedia

    en.wikipedia.org/wiki/Oxidation_state

    The bond-order formula at the bottom is closest to the reality of four equivalent oxygens each having a total bond order of 2. That total includes the bond of order ⁠ 1 / 2 ⁠ to the implied cation and follows the 8 − N rule [7] requiring that the main-group atom's bond-order total equals 8 − N valence electrons of the neutral atom ...

  6. Oxygen - Wikipedia

    en.wikipedia.org/wiki/Oxygen

    The bond can be variously described based on level of theory, but is reasonably and simply described as a covalent double bond that results from the filling of molecular orbitals formed from the atomic orbitals of the individual oxygen atoms, the filling of which results in a bond order of two.

  7. Molecular orbital theory - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital_theory

    Bond order is the number of chemical bonds between a pair of atoms. The bond order of a molecule can be calculated by subtracting the number of electrons in anti-bonding orbitals from the number of bonding orbitals, and the resulting number is then divided by two. A molecule is expected to be stable if it has bond order larger than zero.

  8. Multiplicity (chemistry) - Wikipedia

    en.wikipedia.org/wiki/Multiplicity_(chemistry)

    In contrast, the first and second excited states of dioxygen are both states of singlet oxygen. Each has two electrons of opposite spin in the π* level so that S = 0 and the multiplicity is 2S + 1 = 1 in consequence. In the first excited state, the two π* electrons are paired in the same orbital, so that there are no unpaired electrons.

  9. Molecular orbital - Wikipedia

    en.wikipedia.org/wiki/Molecular_orbital

    This is called a covalent bond. The bond order is equal to the number of bonding electrons minus the number of antibonding electrons, divided by 2. In this example, there are 2 electrons in the bonding orbital and none in the antibonding orbital; the bond order is 1, and there is a single bond between the two hydrogen atoms. [citation needed]