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  2. Lewis structure - Wikipedia

    en.wikipedia.org/wiki/Lewis_structure

    Sum of TVe will be an odd number. Bond number will not be a whole number. Round calculated bond number down to the nearest whole number. (e.g. 4.5 bonds would round down to 4 bonds) Valence Shell Deficiency: Does not break the system, must instead memorize when it occurs. BeX 2, BX 3, and AlX 3. "X" represents Hydrogen or Halogens.

  3. Bond graph - Wikipedia

    en.wikipedia.org/wiki/Bond_graph

    Bond graphs are multi-energy domain (e.g. mechanical, electrical, hydraulic, etc.) and domain neutral. This means a bond graph can incorporate multiple domains seamlessly. The bond graph is composed of the "bonds" which link together "single-port", "double-port" and "multi-port" elements (see below for details).

  4. Molecular graph - Wikipedia

    en.wikipedia.org/wiki/Molecular_graph

    A chemical graph is a labeled graph whose vertices correspond to the atoms of the compound and edges correspond to chemical bonds. Its vertices are labeled with the kinds of the corresponding atoms and edges are labeled with the types of bonds. [1] For particular purposes any of the labelings may be ignored. A hydrogen-depleted molecular graph ...

  5. 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 connected to one another. [1]

  6. Chemical graph generator - Wikipedia

    en.wikipedia.org/wiki/Chemical_graph_generator

    In graph theory, the degree of a vertex is its number of connections. In a chemical graph, the maximum degree of an atom is its valence, and the maximum number of bonds a chemical element can make. For example, carbon's valence is 4. In a chemical graph, an atom is saturated if it reaches its valence. A graph is connected if there is at least ...

  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. Topological index - Wikipedia

    en.wikipedia.org/wiki/Topological_index

    In the fields of chemical graph theory, molecular topology, and mathematical chemistry, a topological index, also known as a connectivity index, is a type of a molecular descriptor that is calculated based on the molecular graph of a chemical compound. [1]

  9. Dipole graph - Wikipedia

    en.wikipedia.org/wiki/Dipole_graph

    In graph theory, a dipole graph, dipole, bond graph, or linkage, is a multigraph consisting of two vertices connected with a number of parallel edges. A dipole graph containing n edges is called the size-n dipole graph, and is denoted by D n. The size-n dipole graph is dual to the cycle graph C n. The honeycomb as an abstract graph is the ...