Microwave Spectrum of Methane-d2, CH2D2

1975 ◽  
Vol 53 (19) ◽  
pp. 2023-2028 ◽  
Author(s):  
Eizi Hirota ◽  
Misako Imachi

Three rotational transitions of methane-d2 were observed by a source-modulation microwave spectrometer. The two differences in the rotational constants, A – C and B – C, were determined to be 37 555.758 and 13 664.280 MHz, respectively, from the observed frequencies of 110 ← 101 and 211 ← 202 after correcting for the centrifugal distortion effects. The centrifugal distortion constants were evaluated by a normal coordinate analysis. The dipole moment of CH2D2 was determined to be 0.014 ± 0.005 D, by comparing the intensity of 211 ← 202 with that of an oxygen line.

1991 ◽  
Vol 46 (3) ◽  
pp. 229-232 ◽  
Author(s):  
J.-U. Grabow ◽  
N. Heineking ◽  
W. Stahl

AbstractWe recorded the microwave spectrum of hexafluoropropanone between 7 and 15 GHz using a pulsed molecular beam microwave Fourier transform spectrometer. The rotational constants were determined to be A = 2181.71980(14) MHz, B= 1037.22930(7) MHz, C = 934.89233(8) MHz, the quartic centrifugal distortion constants are D'J= 0.07378 (39) kHz, D'JK = 0.10002(75) kHz, D'K = -0.07269(266) kHz, δ'J = 0.00623(29) kHz and R' 6= 0.00755(12) kHz. Stark effect measurements yielded a dipole moment μ = μb= 0.3949 (18) D


1975 ◽  
Vol 53 (15) ◽  
pp. 2247-2251 ◽  
Author(s):  
W. V. F. Brooks ◽  
K. V. L. N. Sastry

The microwave spectra of glycidol [Formula: see text] and its deuterated (—OD) form have been studied in the range 8–40 GHz. The rotational (in MHz) and centrifugal distortion constants (in kHz) of glycidol are: A = 10 347.87, B = 4102.36, C = 3781.95; ΔJ = 2.38, ΔJK = −311, ΔK = 5.2, δJ = 0.3159, δK = −9.76. The rotational constants and distortion constants of glycidol (OD) are A = 10 010.31, B = 4056.73, C = 3717.02; ΔJ = 2.53, ΔJK = 197, ΔK = 7.7,δJ = 0.3532,δK = −7.19. The dipole moment components of the normal molecule in Debye units are μa = 0.61, μb = 1.20, μc = 0.52, and the total dipole moment is 1.44 D.A structure is derived with the alcoholic hydrogen atom close (2.5 Å) to the ring oxygen. The structure and the absence of signs of free or hindered rotation, can be accounted for by hydrogen bonding between the proton and the ring oxygen.


1994 ◽  
Vol 72 (11-12) ◽  
pp. 1206-1212 ◽  
Author(s):  
Mitsuaki Izuha ◽  
Satoshi Yamamoto ◽  
Shuji Saito

The rotational spectra of silacyclopropenylidene, c-C2H2Si, and its isotopic species (C2H229Si, C2D2Si, 13C2H2Si) were observed in the frequency region of 220–400 GHz by using a source-modulated microwave spectrometer combined with a free space absorption cell. c-C2H2Si was produced in the cell by discharging a mixture of SiH4, C2H2, and He. Least-squares analyses of the observed spectral lines yielded the rotational constants and the centrifugal distortion constants for the normal and its isotopic species. From the observed rotational constants, the rs structure was determined: rs (C=C) = 1.3458 Å, rs (C—Si) = 1.8200 Å rs (C—H) = 1.0795 Å, and [Formula: see text]. (1 Å = 10−10 m.)


1989 ◽  
Vol 44 (7) ◽  
pp. 680-682 ◽  
Author(s):  
Michael Krüger ◽  
Helmut Dreizler

Abstract The ground state rotational spectrum of 2-isocyano-propane is assigned. The rotational constants and the quartic centrifugal distortion constants are determined by Microwave Fourier Transform (MWFT) Spectroscopy. The analysis of the Stark effect leads to a total dipole moment of 4.055(1) D.


1977 ◽  
Vol 55 (14) ◽  
pp. 1211-1217 ◽  
Author(s):  
S. D. Sharma ◽  
S. Doraiswamy

The microwave spectrum of 1,2,3,5-tetrafluorobenzene has been studied at dry ice temperature in the frequency region of 8 to 12.4 GHz. The molecule is highly asymmetric (κ = 0.001129) and exhibits an a-type spectrum. The analysis of the spectrum has been carried out to obtain the following Watson's eight determinable parameters: [Formula: see text], [Formula: see text], [Formula: see text], τ′aaaa = −1.30 ± 1.26 kHz, τ′bbbb = −4.05 ± 0.40 kHz, τ′cccc = −0.75 ± 0.40 kHz, τ1 = −15.21 ± 1.34 kHz and [Formula: see text]. The dipole moment of the molecule is found to be 1.46 ± 0.06 D. The calculated values obtained from INDO and CNDO approximations are 1.73 and 1.64 D, respectively. The benzene ring appears to have undergone a distortion if we assume that C(sp2)—F bond length is around 135 pm.


1976 ◽  
Vol 31 (6) ◽  
pp. 594-601 ◽  
Author(s):  
R. Hamm ◽  
H. J. Kohrmann ◽  
H. Günther ◽  
W. Zeil

The microwave spectrum of the isotopic species 12C34SF37Cl has been measured in natural abundance. The three rotational constants and five quartic centrifugal distortion constants have been determined by a least square fit. In comparison with our former calculations, the five structural r0-parameters of the planar molecule have now been determined from eight rotational constants instead of six, thus yielding remarkably smaller confidence intervalls. Furthermore an re-structure has been calculated and an equilibrium-structure has been estimated


1974 ◽  
Vol 29 (7) ◽  
pp. 1081-1096 ◽  
Author(s):  
V. Typke ◽  
M. Dakkouri ◽  
W. Zeil

The MW-spectra of trans- and gauche-rotamers of 5 isotopes of ethylchlorosilane have been measured and partially analyzed. From the analysis rotational constants, centrifugal distortion constants and nuclear quadrupol coupling constants have been obtained. The determination of the restructure from 30 rotational constants leads to different bond angles C -C -Si for the two conformers. The optimalization of the quadrupol coupling constants in the bond axis system on the basis of the r0-structure using all information on the 35Cl-species yields the following values: ZZZ = (-35.5±0.8) MHz, η = - 0.25±0.11 for the trans-form and ZZZ= (-36.3±2.7) MHz, η = -0.08±0.10 for the gauche-form.


1975 ◽  
Vol 30 (11) ◽  
pp. 1441-1446
Author(s):  
W. Zeil ◽  
W. Braun ◽  
B. Haas ◽  
H. Knehr ◽  
F. Rückert ◽  
...  

The microwave spectra of the following isotopic species of Methyl-chloro-silane: CH3SiH2Cl, CH3SiD2 and CD3SiD2Cl have been measured and the rotational spectroscopic constants (rotational constants, centrifugal distortion constants and nuclear quadrupole coupling constants) have been determined


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