Square planar molecular shape

Practice Problem B For which molecular geometries (linear, bent, trigonal planar, trigonal pyramidal, tetrahedral, square planar, T-shaped, seesaw-shaped, trigonal bipyramidal, square pyramidal, octahedral) can an AB, molecule be nonpolar if there are (a) two drflerent types of terminal atoms and (b) three different types of terminal atoms ... 

Xep4 is best prepared by heating a 1 5 volume mixture of Xe and Fi to 400°C under 6 atm pressure in a nickel vessel. It also is a white, crystalline, easily sublimed solid the molecular shape is square planar (Xe-F 195.2pm) and is essentially the same in both the solid and gaseous phases. Its properties are similar to those of XeFi except that it is a rather stronger fluorinating agent, as shown by the reactions ... 

Three common molecular shapes are associated with octahedral electron group geomehy. Most often, an inner atom with a steric number of 6 has octahedral molecular shape with no lone pairs. Example uses a compound of xenon, whose chemical behavior is described in the Chemical Milestones Box, to show a second common molecular shape, square planar. 

The result here is quite satisfactory because XeF4 does in fact exhibit square planar geometry. It is worth noting, however, that a square planar shape for XeF4 is also predicted by VSEPR theory. Despite the fact that the molecular orbital method has made some inroads as of late, VSEPR is still the best approach available for rationalizing the molecular geometries of noble gas compounds. 

Now you can see that the central atoms has 4 BPs and 2 LPs, a total of 6 electron groups around it. The geometric arrangement of the electron group is octahedral. For 4 BPs and 2 LPs, the molecular shape is square planar. 

In any molecule in which there are no nonbonding pairs around the central atom, the molecular shape is the same as the molecular geometry. Thus, to use the examples from Table 6.2, all three two-substituent molecules have both a linear geometry and a linear shape. Both BH3 and H2CO have a triangular planar shape, CH4 has a tetrahedral shape, PF5 a triangular bipyramidal shape, and SF6 a square bipyramidal shape. 

X-Ray structure shows that Pd is coordinated to four S 55 atoms in a square planar fashion only long range weak axial interactions are observed with the two remaining S atoms, i.e. the conformation of the macrocycle is an S-shaped double boat, with the Pd11 ion at the molecular inversion centre... 

The program and force field SHAPES, developed for transition metal complexes and tested for square planar geometries, uses a single Fourier term (Eq. 2.19), which is similar to the torsional angle term in many molecular mechanics programs (see Section 2.2.3 periodicity = m, phase shift = Fourier force constant kg is related to that of the harmonic potential, kg (Eq. 2.7) by Eq. 2.20. 

The SHAPES force field" has been implemented in CHARMM and used to examine the structures of several square planar rhodium complexes. This force field is based on angular overlap considerations and treats angular distortions for a variety of geometries. Spherical internal coordinates and Fourier potential functions form the basis for the description of these molecular shapes. The parameters for this force field were derived from normal coordinate analysis, ab initio calculations, and structure-based optimizations. The average rms deviation for bond lengths was 0.026 A, and the average rms deviation for bond angles was 3.2°. 

Molecular shape Linear Square planar Octahedral... 

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