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  2. Lewis structure - Wikipedia

    en.wikipedia.org/wiki/Lewis_structure

    Lewis structure of a water molecule. Lewis structures – also called Lewis dot formulas, Lewis dot structures, electron dot structures, or Lewis electron dot structures (LEDs) – are diagrams that show the bonding between atoms of a molecule, as well as the lone pairs of electrons that may exist in the molecule.

  3. Structural formula - Wikipedia

    en.wikipedia.org/wiki/Structural_formula

    Skeletal structural formula of Vitamin B 12.Many organic molecules are too complicated to be specified by a molecular formula.. The structural formula of a chemical compound is a graphic representation of the molecular structure (determined by structural chemistry methods), showing how the atoms are possibly arranged in the real three-dimensional space.

  4. Benzene - Wikipedia

    en.wikipedia.org/wiki/Benzene

    Benzene is a natural constituent of petroleum and is one of the elementary petrochemicals. Due to the cyclic continuous pi bonds between the carbon atoms, benzene is classed as an aromatic hydrocarbon. Benzene is a colorless and highly flammable liquid with a sweet smell, and is partially responsible for the aroma of gasoline.

  5. Simplified Molecular Input Line Entry System - Wikipedia

    en.wikipedia.org/wiki/Simplified_Molecular_Input...

    The Simplified Molecular Input Line Entry System (SMILES) is a specification in the form of a line notation for describing the structure of chemical species using short ASCII strings. SMILES strings can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the molecules.

  6. Benzene (data page) - Wikipedia

    en.wikipedia.org/wiki/Benzene_(data_page)

    *** Benzene is a carcinogen (cancer-causing agent). *** Very flammable. The pure material, and any solutions containing it, constitute a fire risk. Safe handling: Benzene should NOT be used at all unless no safer alternatives are available. If benzene must be used in an experiment, it should be handled at all stages in a fume cupboard.

  7. Hückel method - Wikipedia

    en.wikipedia.org/wiki/Hückel_method

    Delocalization energy is defined as the difference in energy between that of the most stable localized Lewis structure and the energy of the molecule computed from Hückel theory orbital energies and occupancies. Since all energies are relative, we set = without loss of generality to simplify discussion. The energy of the localized structure is ...

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  9. Bond order - Wikipedia

    en.wikipedia.org/wiki/Bond_order

    In molecules which have resonance or nonclassical bonding, bond order may not be an integer.In benzene, the delocalized molecular orbitals contain 6 pi electrons over six carbons, essentially yielding half a pi bond together with the sigma bond for each pair of carbon atoms, giving a calculated bond order of 1.5 (one and a half bond).