Infrared and Raman spectra and vibrational assignment of methylene cyclopropane-h6 and -d6

1970 ◽  
Vol 48 (24) ◽  
pp. 3889-3902 ◽  
Author(s):  
J. E. Bertie ◽  
M. G. Norton
Keyword(s):  
Liquid Phase ◽  
Gas Phase ◽  
Raman Spectra ◽  
Infrared Spectra ◽  
Infrared And Raman Spectra ◽  
Vibrational Assignment ◽  
Isotope Shifts ◽  
Liquid Phases ◽  
Modes Of Vibration ◽  
Depolarization Ratios

Infrared spectra have been recorded in the range 4000 to 20 cm−1 for methylene cyclopropane-h6 and -d6 in the gas phase, and from 4000 to 200 cm−1 for methylene cyclopropane-h6 in the liquid phase. Raman spectra have been recorded for the liquid phases of both species. The fundamental modes of vibration have been assigned using i.r. band contours and Raman depolarization ratios, with the exception of the i.r. inactive A2 modes which were not observed. An interesting feature is the occurrence of remarkably small isotope shifts for certain modes.

THE INFRARED AND RAMAN SPECTRA OF HC(CD3)3 AND DC (CD3)3

1957 ◽  
Vol 35 (9) ◽  
pp. 969-979 ◽  
Author(s):  
J. K. Wilmshurst ◽  
H. J. Bernstein
Keyword(s):  
Raman Spectra ◽  
Infrared Spectra ◽  
Infrared And Raman Spectra ◽  
Vibrational Assignment ◽  
Difference Tones ◽  
Modified Assignments ◽  
Depolarization Ratios

The Raman spectra of liquid (CD3)3CH and (CD3)3CD were obtained photoelectrically together with depolarization ratios, and the infrared spectra of the corresponding gases were obtained from 3 to 35 μ. A vibrational assignment consistent with depolarization ratios and band contours has been made for the molecules on the basis of C3v symmetry. The spectra have been correlated with the spectra of (CH3)3CH and (CH3)3CD and modified assignments for two modes have been given for these molecules. Tentative assignments have been made for the 'inactive' A2 modes (which are 'active' if the molecule has symmetry C3) to explain some of the observed frequencies around 1000 cm.−1 which could not be satisfactorily assigned as summation or difference tones.

Normal Coordinate Analysis of Benitoite (BaTiSi3O9) and its Constituent Ring

1992 ◽  
Vol 291 ◽  
Author(s):  
Charles C. Kim ◽  
M. I. Bell ◽  
D. A. McKeown
Keyword(s):  
Crystal Structure ◽  
Raman Spectra ◽  
Infrared Spectra ◽  
Normal Modes ◽  
Infrared And Raman Spectra ◽  
Normal Coordinate ◽  
Structure Space ◽  
New Information ◽  
Atomic Interactions ◽  
Modes Of Vibration

ABSTRACTThe normal modes of vibration and their frequencies are calculated for benitoite, a mineral whose crystal structure (space group D23h) consists of three-membered silicate rings (Si3O9) linked by Ba+2 and Ti+4 ions. The calculation unambiguously assigns the normal modes to the lines in the Raman and infrared spectra and determines the atomic interactions. On the assumption that mode mixings and splittings due to inter-ring interactions are small, the normal frequencies of the isolated ring of C3h, symmetry are determined. The identification of normal modes characteristic of three-membered silicate rings may prove to be a valuable guide in the interpretation of the infrared and Raman spectra of amorphous silicates, potentially leading to new information on the ring statistics of these materials.

Infrared and Raman Spectra of Spiropentane-H8

1972 ◽  
Vol 26 (5) ◽  
pp. 540-542 ◽  
Author(s):  
G. R. Burns ◽  
D. G. McGavin
Keyword(s):  
Low Temperature ◽  
Infrared Spectrum ◽  
Gas Phase ◽  
Raman Spectra ◽  
Infrared Spectra ◽  
Sufficient Information ◽  
Infrared And Raman Spectra ◽  
Calorimetric Data ◽  
Crystalline Films ◽  
Twist Mode

Infrared and Raman spectra have been measured for spiropentane-H8. Raman spectra for the liquid have enabled the b1 species ring twist to be assigned. Previous assignments of this mode were based on calorimetric data and on the assignment of a band in the infrared spectrum to a combination band involving the ring twist mode. Infrared spectra of low temperature crystalline films have provided sufficient information that, when taken with the Raman data and gas phase infrared spectra, we have assignments for all of the fundamental modes.

THE VIBRATIONAL SPECTRA OF ACETALDEHYDE AND ACETALDEHYDE-d1

1956 ◽  
Vol 34 (8) ◽  
pp. 1083-1092 ◽  
Author(s):  
J. C. Evans ◽  
H. J. Bernstein
Keyword(s):  
Raman Spectra ◽  
Infrared Spectra ◽  
Vibrational Spectra ◽  
Vibrational Assignment ◽  
Depolarization Ratios

The Raman spectra of liquid CH3CHO and CH3CDO were obtained photo-electrically and depolarization ratios measured. Infrared spectra of the vapors and solids were also obtained. A vibrational assignment is given and the spectra correlated. The vibrational spectra of the acetyl halides reported in the literature are also correlated.

The Infrared and Raman Spectra of α- and β-Pinenes

1976 ◽  
Vol 30 (2) ◽  
pp. 209-212 ◽  
Author(s):  
H. William Wilson
Keyword(s):  
Liquid Phase ◽  
Raman Spectra ◽  
Vapor Phase ◽  
Infrared Spectra ◽  
Infrared And Raman Spectra

The liquid phase infrared and Raman spectra of α-pinene (2,6,6-trimethyl bicyclo[3.1.1] hept-2-ene) and β-pinene (6,6-dimethyl-2-methylene bicyclo [3.1.1] heptane) have been scanned between 100 and 4000 cm−1 and the vapor phase infrared spectra of both compounds between 625 and 4000 cm−1. A number of the 72 allowed modes of the C10H16 isomers can be assigned on the basis of group frequencies.

THE INFRARED AND RAMAN SPECTRA OF TOLUENE, TOLUENE-α-d3, m-XYLENE, AND m-XYLENE-αα′-d6

1957 ◽  
Vol 35 (8) ◽  
pp. 911-925 ◽  
Author(s):  
J. K. Wilmshurst ◽  
H. J. Bernstein
Keyword(s):  
Raman Spectra ◽  
Infrared Spectra ◽  
Infrared And Raman Spectra ◽  
Polarization Data ◽  
Vibrational Assignments ◽  
Ratio Rule ◽  
Depolarization Ratios

The infrared spectra of toluene, toluene-α-d3, m-xylene, and m-xylene-αα′-d6 have been obtained from 2 to 30 μ for the vapors and liquids. The Raman spectra of the liquids have also been obtained photoelectrically together with depolarization ratios. Vibrational assignments have been made for the four molecules consistent with vapor band contours, polarization data, the Teller Redlich ratio rule, and a modified ratio rule due to Fitzer and Scott.

The Infrared and Raman Spectra and Vibrational Assignment of t-Butyl Bromide-h9 and -d9

1973 ◽  
Vol 51 (20) ◽  
pp. 3344-3353 ◽  
Author(s):  
John E. Bertie ◽  
Sham Sunder
Keyword(s):  
Thermodynamic Properties ◽  
Raman Spectra ◽  
Infrared Spectra ◽  
Average Error ◽  
Infrared And Raman Spectra ◽  
Vibrational Assignment ◽  
Normal Coordinate ◽  
Butyl Bromide ◽  
Fundamental Frequencies ◽  
Liquid States

The infrared spectra between 4000 and 10 cm−1 of t-butyl bromide-h9 and -d9 in the gas and liquid states, and the Raman spectra between 3500 and 10 cm−1 of the liquids under parallel and perpendicular polarizations, have been recordeds and assigned. The compatibility of the assignments for the light and heavy molecules has been checked by normal coordinate calculations, in which 14 valence force constants have reproduced 40 fundamental frequencies with an average error of 1.5%. The calculated thermodynamic properties of both molecules are presented for temperatures between 50 and 500 °K.

Sign in / Sign up

Export Citation Format

Share Document