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  2. Square pyramidal molecular geometry - Wikipedia

    en.wikipedia.org/wiki/Square_pyramidal_molecular...

    Structure of xenon oxytetrafluoride, an example of a molecule with the square pyramidal coordination geometry. Square pyramidal geometry describes the shape of certain chemical compounds with the formula ML 5 where L is a ligand. If the ligand atoms were connected, the resulting shape would be that of a pyramid with a square base.

  3. 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.

  4. Coordination geometry - Wikipedia

    en.wikipedia.org/wiki/Coordination_geometry

    In a crystal structure the coordination geometry of an atom is the geometrical pattern of coordinating atoms where the definition of coordinating atoms depends on the bonding model used. [1] For example, in the rock salt ionic structure each sodium atom has six near neighbour chloride ions in an octahedral geometry and each chloride has ...

  5. VSEPR theory - Wikipedia

    en.wikipedia.org/wiki/VSEPR_theory

    Shows location of unpaired electrons, bonded atoms, and bond angles. 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 ...

  6. Geometry index - Wikipedia

    en.wikipedia.org/wiki/Geometry_index

    where: α and β are the two greatest valence angles of coordination center; θ = cos −1 (− 1 ⁄ 3) ≈ 109.5° is a tetrahedral angle. When τ 4 is close to 0 the geometry is similar to square planar, while if τ 4 is close to 1 then the geometry is similar to tetrahedral.

  7. Bent's rule - Wikipedia

    en.wikipedia.org/wiki/Bent's_rule

    According to VSEPR theory, diethyl ether, methanol, water and oxygen difluoride should all have a bond angle of 109.5 o. [12] Using VSEPR theory, all these molecules should have the same bond angle because they have the same "bent" shape. [12] Yet, clearly the bond angles between all these molecules deviate from their ideal geometries in ...

  8. Walsh diagram - Wikipedia

    en.wikipedia.org/wiki/Walsh_diagram

    For the simplest AH 2 molecular system, Walsh produced the first angular correlation diagram by plotting the ab initio orbital energy curves for the canonical molecular orbitals while changing the bond angle from 90° to 180°. As the bond angle is distorted, the energy for each of the orbitals can be followed along the lines, allowing a quick ...

  9. Capped square antiprismatic molecular geometry - Wikipedia

    en.wikipedia.org/wiki/Capped_square_anti...

    Square antiprisms can be capped on both square faces, giving bicapped square antiprismatic molecular geometry. The bicapped square antiprismatic atoms surrounding a central atom define the vertices of a gyroelongated square bipyramid. [2] The symmetry group of this object is D 4d. [3] Examples: B 10 H 12, defined by the B 10 framework