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By removing the assumption that all hybrid orbitals are equivalent, Bent's rule leads to improved predictions of molecular geometry and bond strengths. [4] [5] Bent's rule can be justified through the relative energy levels of s and p orbitals. Bent's rule represents a modification of VSEPR theory for molecules of lower than ideal symmetry. [6]
Water (H 2 O) is an example of a bent molecule, as well as its analogues. The bond angle between the two hydrogen atoms is approximately 104.45°. [ 1 ] Nonlinear geometry is commonly observed for other triatomic molecules and ions containing only main group elements, prominent examples being nitrogen dioxide (NO 2 ), sulfur dichloride (SCl 2 ...
In contrast, the extra stability of the 7p 1/2 electrons in tennessine are predicted to make TsF 3 trigonal planar, unlike the T-shaped geometry observed for IF 3 and predicted for AtF 3; [39] similarly, OgF 4 should have a tetrahedral geometry, while XeF 4 has a square planar geometry and RnF 4 is predicted to have the same.
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 ...
This is because according to Bent's rule, the C–F bond gains p-orbital character leading to high s-character in the C–H bonds, and H–C–H bond angles approaching those of sp 2 orbitals – e.g. 120° – leaving less for the F–C–H bond angle. The difference is again explained in terms of bent bonds. [3]
As predicted by VSEPR theory, the molecule adopts a bent molecular geometry. [citation needed] It is a strong oxidizer and has attracted attention in rocketry for this reason. [5] With a boiling point of −144.75 °C, OF 2 is the most volatile (isolable) triatomic compound. [6] The compound is one of many known oxygen fluorides.
Molecular geometry is the three-dimensional arrangement of the atoms that constitute a molecule. It includes the general shape of the molecule as well as bond lengths , bond angles , torsional angles and any other geometrical parameters that determine the position of each atom.
For example, in carbon dioxide (CO 2), which does not have a lone pair, the oxygen atoms are on opposite sides of the carbon atom (linear molecular geometry), whereas in water (H 2 O) which has two lone pairs, the angle between the hydrogen atoms is 104.5° (bent molecular geometry).