Microwave Spectrum, Molecular Structure, and Bromine Nuclear Quadrupole Coupling Tensor of Bromodiborane

1970 ◽  
Vol 53 (5) ◽  
pp. 1851-1859 ◽  
Author(s):  
Arthur C. Ferguson ◽  
C. D. Cornwell
Keyword(s):  
Molecular Structure ◽  
Microwave Spectrum ◽  
Coupling Tensor ◽  
Quadrupole Coupling ◽  
Nuclear Quadrupole

The 33S Nuclear Quadrupole Hyperfine Structure in the Rotational Spectrum of 32S, 33S Dimethyl Disulfide

1995 ◽  
Vol 50 (2-3) ◽  
pp. 131-136 ◽  
Author(s):  
H. Hartwig ◽  
U. Kretschmer ◽  
H. Dreizler
Keyword(s):  
Molecular Beam ◽  
Dimethyl Disulfide ◽  
Microwave Spectroscopy ◽  
Rotational Spectrum ◽  
Centrifugal Distortion ◽  
Coupling Tensor ◽  
Quadrupole Coupling ◽  
Rotation Parameters ◽  
Nuclear Quadrupole ◽  
Centrifugal Distortion Constants

Abstract We investigated the rotational spectrum of 32S, 33S dimethyl disulfide in natural abundance by molecular beam Fourier transform microwave spectroscopy. We were able to determine the com­plete 33S quadrupole coupling tensor, the rotational and centrifugal distortion constants and the internal rotation parameters of the two methyl tops. The rotational constants were found to be A = 8113.8847(23) MHz, B = 2800.6203(30) MHz and C = 2557.2245 (32) MHz. The results are compared with former publications.

THE MICROWAVE SPECTRUM OF DICHLOROFLUOROMETHANE

1964 ◽  
Vol 42 (4) ◽  
pp. 720-730 ◽  
Author(s):  
David B. McLay
Keyword(s):  
Bond Length ◽  
Hyperfine Structure ◽  
Charge Distribution ◽  
Tensor Component ◽  
Microwave Spectrum ◽  
Frequency Range ◽  
Rotational Constants ◽  
Coupling Tensor ◽  
Quadrupole Coupling ◽  
Out Of Plane

The microwave spectra of C12HFCl235 and C12HFCl35Cl37 have been measured in the frequency range from 10 to 35 Gc/s. Enough R branch and Q branch rotational transitions have been measured in each case to determine the rotational constants A = 6988.73 ± 0.02, B = 3307.25 ± 0.05, and C = 2350.03 ± 0.02 Mc/s for CHFCl235 and A = 6943.37 ± 0.05, B = 3219.58 ± 0.04, and C = 2300.57 ± 0.06 Mc/s for CHFCl35Cl37. The out-of-plane coordinate of Cl35 in the symmetric species has been deduced to be 1.4350 ± 0.0006 Å and, if the C–Cl bond length is assumed to be 1.750 ± 0.005 Å, then the Cl–C–Cl angle can be calculated to be 112.2 ± 0.5°. The analysis of the hyperfine structure has led to the values eQVaa = −41.0 ± 0.2 Mc/s, eQVbb = +11.37 ± 0.13 Mc/s, and eQVcc = 29.62 ± 0.13 Mc/s for the diagonal components of the quadrupole coupling tensor along the principal inertial axes. The results are consistent with a cylindrically symmetrical charge distribution around the C–Cl bond and a quadrupole coupling tensor component of eQVzz = −76.75 Mc/s in the direction of the bond. The only impurity in the sample, obtained from the Matheson Company, seems to have been a trace of HCCF for which the J = 0 → 1 transition has been measured.

Microwave Spectrum and Nuclear Quadrupole Coupling of 2-Chloropyridine

1987 ◽  
Vol 42 (2) ◽  
pp. 197-206 ◽  
Author(s):  
M. Meyer ◽  
U. Andresen ◽  
H. Dreizler
Keyword(s):  
Excited State ◽  
Ground State ◽  
Microwave Spectrum ◽  
Coupling Constants ◽  
Vibrationally Excited ◽  
Isotopic Species ◽  
Quadrupole Coupling ◽  
Nuclear Quadrupole ◽  
Mo Theory

The microwave spectrum of 2-chloropyridine, 2-Cl(C5H4N), has been studied to determine the 35Cl, 37Cl and 14N nuclear quadrupole coupling constants. The results are discussed within a simple MO theory. We propose an approximate r0-structure under certain assumptions. In addition to the ground state we observed one vibrationally excited state of both chlorine isotopic species of 2-chloropyridine.

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