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Give the ground state MO diagrams of PN, SO- , and XeF. (MO DIAGRAMS PLZ)
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- Sketch the MO diagram for 1,3 budadiene. Identify the HOMO and LUMO along with all symmetric MO’s, asymmetric MO’s, bonding MO’s, and anti bonding MO’s.Sketch the MO diagram for 1,3 butadieneDraw the MO diagram of linear NO2 by consulting the character tables and orbital energies, and to align your O/N/O axes. Remember to use a lower symmetry point group for the linear molecule. What is the bond order of linear NO2? How does it change if you make it NO2 - or NO2 +. Draw each SALC and look for interactions between the orbitals.
- a.) Sketch for yourself the MO diagram for the following three heteronuclear diatomic species. Give the bond order of: CO, NO, CN^- b.) Sketch for yourself the molecular orbital energy level diagram for KrF and deduce its ground state electron configurations. Is KrF likely to have a shorter or longer or same bond length as KrF+?The HuckeI energies of the four π orbitals of cyclobutadiene are α + 2β, α, α, and α - 2β, What is the delocalization energy?Draw the complete MO diagram for [CoCl6]4- Label the AOs and SALCs and MOs. Draw a sketch for each MO with the appropriate symmetry label
- Apply the Hückel approximation on the conjugated molecule, 1,3,5 – hexatriene, C6H8 to carry the following tasks: (a) Set up the secular determinant (b) Solve the secular determinant to obtain the roots (E1, E2, …). (c) Draw the Hückel molecular orbital (MO) energy diagram and identify the frontier orbitals (HOMO and LUMO) (d) Write the electron configuration based on the Hückel molecular orbitals (e) Calculate the pi electronic energy, Epi (f) Calculate the pi-bond formation energy, Ebf (g) What is the lowest excitation energy?How would you draw a molecular orbital diagram of butadiene showing the energies and occupancy ofthe orbitals in the ground state? How would you estimate the total pi binding energy of the molecule?Which MOs are symmetric, and which are antisymmetric? for the MOs of 1,3,5-hexatriene:
- what is the molecular orbital diagram of AlP? scale it to show splitting and all co tributions to MO from the AO. Draw MO modes for each MO formed. can this exist in the real world?NO3- (d3h) MO diagram.. needed in irreducible formGiven molecule: PCl3 and NH3 1. Identify point group 2. Draw Lewis structure, and identify molecular shape according to VSEPR theory 3. Indicate coordinates of each atom 4. Use projection operator method to construct MO diagram 5. Sketch all atomic and group orbitals (show the phase/polarity (as necessary)) 6. Indicate the symmetry of each atomic and group orbitals 7. Sketch the molecular orbitals that satisfy all the conditions for overlap (with corresponding anti-bonding MOs), and all the non-bonding MOs. 8. Sketch the final MO diagram.