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 Title: MICROWAVE SPECTRA OF 9-FLUORENONE AND BENZOPHENONE Author(s): Sedo, Galen Contributor(s): van Wijngaarden, Jennifer; West, Channing Subject(s): Structure determination Abstract: The pure rotational spectra of 9-fluorenone (C$_{13}$H$_{8}$O) and benzophenone (C$_{13}$H$_{10}$O) were observed using chirped-pulse Fourier transform microwave spectroscopy (cp-FTMW). The 9-fluorenone spectrum was collected between 8 and 13 GHz, which allowed for the assignment of 124 rotational transitions. A separate spectrum spanning from 8 to 14 GHz was collected for benzophenone, allowing for the assignment of 133 rotational transitions. Both aromatic ketones exhibited strong b-type spectra with little to no centrifugal distortion, indicating highly rigid molecular structures. A comparison of the experimentally determined spectral constants of 9-fluorenone to those calculated using both ab initio and density functional theory strongly suggest the molecule conforms to a planar C$_{2v}$ symmetric geometry as expected for its polycyclic structure. Whereas, a comparison of the experimental benzophenone constants to those predicted by theory suggests a molecule with non-planar C$_{2}$ symmetry, where the two phenyl groups are rotated approximately $32^{circ}$ out-of-plane to form a paddlewheel like geometry. Issue Date: 22-Jun-15 Publisher: International Symposium on Molecular Spectroscopy Citation Info: ACS Genre: CONFERENCE PAPER/PRESENTATION Type: Text Language: English URI: http://hdl.handle.net/2142/79377 Date Available in IDEALS: 2016-01-05
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