THE RAMAN SPECTRUM OF ETHANE-1,1,1-d3

1967 ◽  
Vol 45 (12) ◽  
pp. 3823-3835 ◽  
Author(s):  
D. E. Shaw ◽  
H. L. Welsh

The Raman spectrum of CH3–CD3 at 1 atm pressure was photographed with a spectral resolution of ~0.3 cm−1. The nondegenerate ν1 and ν3 and the doubly degenerate ν7 and ν11 fundamentals were observed. Analyses of the rotational structure of the ν3 and ν7 bands gave the rotational constants, B0 = 0.549 1 ± 0.000 3 cm−1 and A0 = 1.7809 ± 0.0016 cm−1, respectively. These are consistent with rotational constants previously obtained for C2H6 and C2D6.

1969 ◽  
Vol 47 (24) ◽  
pp. 2879-2881 ◽  
Author(s):  
H. Fast ◽  
H. L. Welsh ◽  
D. W. Lepard

The rotational Raman spectrum of gaseous NO was photographed with a spectral resolution of ~0.3 cm−1. In longer exposures the rotational structure of the electronic transition, [Formula: see text], was also observed. It consists of O, P, Q, R, and S branches and has an intensity distribution in accordance with theory.


1970 ◽  
Vol 48 (14) ◽  
pp. 1664-1674 ◽  
Author(s):  
D. W. Lepard

This paper presents a method for calculating the relative intensities and Raman shifts of the rotational structure in electronic Raman spectra of diatomic molecules. The method is exact in the sense that the wave functions used for the calculations may belong to any intermediate case of Hund's coupling schemes. Using this method, theoretical calculations of the pure rotational and electronic Raman spectrum of NO, and the pure rotational Raman spectrum of O2, are presented. Although a calculated stick spectrum for NO was previously shown by Fast et al., the details of this calculation are given here for the first time.


2019 ◽  
Vol 73 (10) ◽  
pp. 1160-1171 ◽  
Author(s):  
Joshua M. Ottaway ◽  
Ashley Allen ◽  
Abigail Waldron ◽  
Phillip H. Paul ◽  
S. Michael Angel ◽  
...  

A spatial heterodyne Raman spectrometer (SHRS), constructed using a modular optical cage and lens tube system, is described for use with a commercial silica and a custom single-crystal (SC) sapphire fiber Raman probe. The utility of these fiber-coupled SHRS chemical sensors is demonstrated using 532 nm laser excitation for acquiring Raman measurements of solid (sulfur) and liquid (cyclohexane) Raman standards as well as real-world, plastic-bonded explosives (PBX) comprising 1,3,5- triamino- 2,4,6- trinitrobenzene (TATB) and octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) energetic materials. The SHRS is a fixed grating-based dispersive interferometer equipped with an array detector. Each Raman spectrum was extracted from its corresponding fringe image (i.e., interferogram) using a Fourier transform method. Raman measurements were acquired with the SHRS Littrow wavelength set at the laser excitation wavelength over a spectral range of ∼1750 cm−1 with a spectral resolution of ∼8 cm−1 for sapphire and ∼10 cm−1 for silica fiber probes. The large aperture of the SHRS allows much larger fiber diameters to be used without degrading spectral resolution as demonstrated with the larger sapphire collection fiber diameter (330 μm) compared to the silica fiber (100 μm). Unlike the dual silica fiber Raman probe, the dual sapphire fiber Raman probe did not include filtering at the fiber probe tip nearest the sample. Even so, SC sapphire fiber probe measurements produced less background than silica fibers allowing Raman measurements as close as ∼85 cm−1 to the excitation laser. Despite the short lengths of sapphire fiber used to construct the sapphire probe, well-defined, sharp sapphire Raman bands at 420, 580, and 750 cm−1 were observed in the SHRS spectra of cyclohexane and the highly fluorescent HMX-based PBX. SHRS measurements of the latter produced low background interference in the extracted Raman spectrum because the broad band fluorescence (i.e., a direct current, or DC, component) does not contribute to the interferogram intensity (i.e., the alternating current, or AC, component). SHRS spectral resolution, throughput, and signal-to-noise ratio are also discussed along with the merits of using sapphire Raman bands as internal performance references and as internal wavelength calibration standards in Raman measurements.


1971 ◽  
Vol 40 ◽  
pp. 44-47
Author(s):  
R. A. Hanel ◽  
V. G. Kunde ◽  
T. Meilleur ◽  
G. Stambach

The thermal emission spectra of Venus, Mars, Jupiter, and the moon were observed at the coude focus of the McDonald Observatory 107-inch telescope in the 400–1400 cm−1 spectral range with spectral resolutions of 0.3–0.7 cm−1. A preliminary interpretation of the Venus/lunar ratio spectrum allows identification of four upper state CO2 bands in the Venusian atmosphere at 791, 828, 865, and 961 cm−1 and confirms previous observations of the broad absorption-like depression around 890 cm−1. The rotational structure of the 791 and 961 cm−1 bands is well developed at this spectral resolution.


1954 ◽  
Vol 32 (10) ◽  
pp. 630-634 ◽  
Author(s):  
B. P. Stoicheff

The pure rotational spectrum and the Q branch of the 1–0 band of N2 were photographed in the second order of a 21 ft. grating. An analysis of the rotational spectrum yields the rotational constants[Formula: see text]The value of B0 together with the Bν values obtained from the electronic bands of N2 gives[Formula: see text]Revised values of the vibrational constants have also been calculated using the results of the present work and the published data on the electronic spectra.


1975 ◽  
Vol 53 (19) ◽  
pp. 1814-1824 ◽  
Author(s):  
M. J. Robey ◽  
I. G. Ross

The absorption spectrum of isobenzofuran vapor has been photographed at resolving powers in excess of 300 000. The vibrational structure is straightforward, involving totally symmetric vibrations only. The rotational structure of a band at 0 + 858 cm−1 has been analyzed as a type B band, leading to the assignment of the transition as 1B2 ← 1A1. The detailed structure of the band is described. The changes in the rotational constants are ΔA + 0.000124, ΔB −0.000122, and ΔC −0.00052 cm−1. A calculated excited state structure compatible with these results is proposed.


1983 ◽  
Vol 61 (9) ◽  
pp. 1347-1358 ◽  
Author(s):  
M. Singh ◽  
M. D. Saksena

Several bands of the C2Πr – X2Σ+transition of AlO in the region 2800–3400 Å have been photographed at high resolution. A unique and unambiguous analysis of the rotational structure has been done for the first time for the 2–0, 1–0, 2–1, 0–0, 1–1, 0–1, 1–2, and 0–2 bands of this system. Fairly accurate rotational constants Beff and Deff have been determined for the ν = 2, 1, and 0 levels of the C2Πr state. Severe rotational perturbations have been observed in the C2Π, state.Equilibrium rotational constants (in cm−1) of the C2Π, state are Be ≈ 0.6049 and αe ≈ 0.0046.


1962 ◽  
Vol 40 (11) ◽  
pp. 1567-1582 ◽  
Author(s):  
D. W. Lepard ◽  
D. M. C. Sweeney ◽  
H. L. Welsh

The Raman spectrum of C2D6 at 1 atm pressure was photographed with a spectral resolution of ~ 0.4 cm−1. Of the six Raman-active fundamentals, v1, v2, v3, v10, and v11 were observed, and the rotational structures of v2, v3, and v10 were analyzed. The structure of v10 confirms the D3d model for the molecule and the analysis gave A0 = 1.3416 cm−1. This value, along with recent infrared values of B0 for C2H6 and C2D6, gives r0(C—H) ≡ r0(C—D) = 1.0914 ± 0.0003 Å, r0(C—C) = 1.5362 ± 0.0005 Å, and [Formula: see text].


1970 ◽  
Vol 48 (5) ◽  
pp. 632-634 ◽  
Author(s):  
K. C. Shotton ◽  
W. Jeremy Jones

The pure rotational Raman spectrum of nitric oxide has been recorded for the first time under high resolution. Analysis of the S-branch transitions yields values of 1.69614 cm−1 and 5.46 × 10−6 cm−1 for the rotational constants B0 and D0, respectively. A series of R-branch lines is observed and is shown to arise from transitions between levels in the 2Π3/2 substate. Some weaker R-branch lines arising from the 2Π1/2 state are also observed. A very weak feature approximately 120 cm−1 from the exciting line is interpreted as the 2Π3/2–2Π1/2 transition.


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