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- Explain why a molecule with a center of inversion cannot have a dipole moment.According to recent spectroscopic results, nitramide is a nonplanar molecule. It was previously thought to be planar. (a) Predict the bond order of the NN bond in the nonplanarstructure. (b) If the molecule really were planar after all, what would be the bond order of the NN bond?Using the Internet, find a Hckel determinant solver and determine the relative energies of the molecular orbitals for a the butadiene molecule, which has four electrons and b the cyclobutadiene molecule, which also has four electrons. Can you explain why cyclobutadiene is labeled with the word antiaromatic?
- A molecule has a C3 rotation axis as its principal axis and a σ reflection plane perpendicular to it. In addition, it has other symmetry elements, but which of the following elements is impossible for it to have? S3 axis C₂ axis OOO ¡ (inversion center) o planeCalculate the induced dipole moment of SO, due to a K+ ion that is 5.2 Å away from the center of the So, molecule. The polarizability of SO, is 3.72×10-30 m3. 4.0 6.6 X D MeterieleIn the MO diagram for a heteronuclear diatomic molecule, the molecular orbitals will include a greater contribution from the atomic orbitals that are further from its energy level. True False
- For homonuclear diatomic molecule 2 sigma anitbonding MO has ungerade symmetry Select one: True False How many pi MO can be formed in the heteronuclear diatomic molecule? Calculate the bond order for the nitrogen gas anion. For a bonding orbital in heteronulcear diatomic molecule, the coefficient for the more electronegative atom is smaller than for a less electronegative. Select one: True FalseE10CAla) Consider the C molecule OF; take the molecule to lie in the yz-plane, with z directed along the C, axis; the mirror plane o, is the yz-plane, and o, is the xz-plane. The combination p(A) + p.(B) of the two Fatoms spans A,, and the combination p (A) – P.(B) of the two Fatoms spans B.. Are there any valence orbitals of the central O atom that can have a non-zero overlap with these combinations of F orbitals? How would the situation be different in SF, where 3d orbitals might be available? E10C.4(b) Consider the same situation as in Exercise E10C.4(a). Find the irreducible representations spanned by the combinations p,(A) + p,(B) and P,(A) - P,(B). Are there any valence orbitals of the central O atom that can have a non-zero overlap with these combinations of F orbitals?(c) What is. potential energy surface (PES)? Draw PES to represent the variation of energy during geometry optimization of a diatomic molecule.