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  2. Bond valence method - Wikipedia

    en.wikipedia.org/wiki/Bond_valence_method

    The bond valence method or mean method (or bond valence sum) (not to be mistaken for the valence bond theory in quantum chemistry) is a popular method in coordination chemistry to estimate the oxidation states of atoms. It is derived from the bond valence model, which is a simple yet robust model for validating chemical structures with ...

  3. VSEPR theory - Wikipedia

    en.wikipedia.org/wiki/VSEPR_theory

    The bond angle for water is 104.5°. Valence shell electron pair repulsion (VSEPR) theory (/ ˈ v ɛ s p ər, v ə ˈ s ɛ p ər / VESP-ər, [1]: 410 və-SEP-ər [2]) is a model used in chemistry to predict the geometry of individual molecules from the number of electron pairs surrounding their central atoms. [3]

  4. Walsh diagram - Wikipedia

    en.wikipedia.org/wiki/Walsh_diagram

    Walsh Diagram of an HAH molecule. Walsh diagrams, often called angular coordinate diagrams or correlation diagrams, are representations of calculated orbital binding energies of a molecule versus a distortion coordinate (bond angles), used for making quick predictions about the geometries of small molecules.

  5. 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.

  6. Oxidation state - Wikipedia

    en.wikipedia.org/wiki/Oxidation_state

    Experimental data show that three metal-oxygen bonds in the octahedron are short and three are long (the metals are off-center). The bond orders (valences), obtained from the bond lengths by the bond valence method, sum up to 2.01 at Fe and 3.99 at Ti; which can be rounded off to oxidation states +2 and +4, respectively:

  7. Lewis structure - Wikipedia

    en.wikipedia.org/wiki/Lewis_structure

    Free Radicals (molecules with unpaired valence electrons) 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 ...

  8. Valence bond theory - Wikipedia

    en.wikipedia.org/wiki/Valence_bond_theory

    A valence bond structure resembles a Lewis structure, but when a molecule cannot be fully represented by a single Lewis structure, multiple valence bond structures are used. Each of these VB structures represents a specific Lewis structure. This combination of valence bond structures is the main point of resonance theory.

  9. Bent's rule - Wikipedia

    en.wikipedia.org/wiki/Bent's_rule

    The assumption that a covalent bond is a linear combination of atomic orbitals of just the two bonding atoms is an approximation (see molecular orbital theory), but valence bond theory is accurate enough that it has had and continues to have a major impact on how bonding is understood. [1]