Microwave spectrum,structure, quadrupole coupling constants and dipole moment of carbon monoxide-borane |
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Authors: | A.C. Venkatachar R.C. Taylor R.L. Kuczkowski |
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Affiliation: | Department of Chemistry. The University of Michigan, Ann Arbor, Michigan, 48109 U.S.A. |
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Abstract: | The J = 0 → 1 and J = 1 → 2 transitions of thirteen isotopic species of carbon monoxide-borane (BH3CO) have been measured. The heavy atom r2 structural parameters have been calculated in several ways so as to minimize the effects of the small carbon coordinate. The structural parameters found are: d(B-C) = 1.534 ± 0.01 Å, d(C-O)= 1.135 ± 0.01 Å. d(B-H)= 1.221 ± 0.001 Å, ∠HBC = 103.79 ± 0.06°, and ∠HBH = 114.50 ± 0.15°. In addition, a complete r0 structure has been calculated by least-squares fitting the moments of inertia of all the isotopic species. A dipole moment of 1.698 ± 0.02 D was determined. |
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