Microwave spectrum,centrifugal perturbation,dipole moment,and conformation of 4-methyl-1,3-dioxane |
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Authors: | A Kh Mamleev R V Galeev L N Gunderova M G Faizullin A A Shapkin |
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Institution: | (1) Institute of Physics of Molecules and Crystals, Ufa Scientific Center, Russian Academy of Sciences, Ufa |
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Abstract: | The microwave spectrum of 4-methyl-1,3-dioxane is studied in a frequency range from 16 GHz to 40 GHz. The rotational transitions of a-, b-, and c-types with J ≤ 57 are identified. The rotational constants (MHz) A = 4802.335(2), B = 2376.163(1), C = 1738.852(1) and the quartic constants of the centrifugal distortion are found for the ground vibrational state of the molecule. The components of the dipole moment (D) μ a = 0.73(1), μb = 1.32(1), μc = 1.36(1) and the total dipole moment μ = 2.03(1) are determined. The experimental data obtained correspond to the chair conformation of the molecule with the equatorial orientation of the methyl group. |
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Keywords: | 4-methyl-1 3-dioxane microwave spectrum conformation dipole moment |
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