Infrared and Raman Spectra of 1,1,2,2‐Tetrachloroethane; Calculation of Normal Vibrations

1955 ◽  
Vol 23 (10) ◽  
pp. 1907-1910 ◽  
Author(s):  
Kazuo Naito ◽  
Ichiro Nakagawa ◽  
Kenji Kuratani ◽  
Isao Ichishima ◽  
San‐ichiro Mizushima
Keyword(s):  
Raman Spectra ◽  
Infrared And Raman Spectra ◽  
Normal Vibrations ◽  
Calculation Of Normal Vibrations

The Vibrational Analysis of Cyclopentanone

1973 ◽  
Vol 51 (11) ◽  
pp. 1749-1766 ◽  
Author(s):  
V. B. Kartha ◽  
H. H. Mantsch ◽  
R. N. Jones
Keyword(s):  
Force Field ◽  
Raman Spectra ◽  
Vibrational Analysis ◽  
Distribution Coefficients ◽  
Force Constants ◽  
Potential Energy Distribution ◽  
Infrared And Raman Spectra ◽  
Normal Vibrations ◽  
Valence Force Field ◽  
Isotopic Species

The infrared and Raman spectra of cyclopentanone, ααα′α′-d4-cyclopentanone, βββ′β′-d4-cyclopentanone and d8-cyclopentanone have been measured and a normal co-ordinate analysis performed based on a twisted C2 conformation. The 36 normal vibrations were computed using a selective valence force field comprising 16 diagonal and 16 off-diagonal force constants. The 4 isotopic species provided 144 frequencies to refine 15 diagonal force constants. The initial values of the constants were transferred from a force field for cyclohexanone computed in this laboratory. The infrared and Raman spectra were analyzed in terms of the potential energy distribution coefficients categorized as group frequencies, zone frequencies, and delocalized frequencies.

Vibration spectra of sulphur tetranitride

1981 ◽  
Vol 46 (11) ◽  
pp. 2613-2619 ◽  
Author(s):  
Jiří Toužín
Keyword(s):  
Solid State ◽  
Raman Spectra ◽  
Normal Coordinate Analysis ◽  
Infrared And Raman Spectra ◽  
Normal Coordinate ◽  
Vibration Spectra

Available data on infrared and Raman spectra of S4N4 in solid state and solutions have been verified and completed. On the basis of normal coordinate analysis an attempt has been made to define with more precision the interpretation of vibration spectra of this compound given in earlier reports.

Vibrational spectra of aquadioxotetra; peroxodivanadates(V) M2[V2O2(O2)4(H2O)]·xH2O (M = N(CH3)4, Cs)

1990 ◽  
Vol 55 (6) ◽  
pp. 1485-1490 ◽  
Author(s):  
Peter Schwendt ◽  
Milan Sýkora
Keyword(s):  
Raman Spectra ◽  
Vibrational Spectra ◽  
Normal Coordinate Analysis ◽  
Force Constants ◽  
Infrared And Raman Spectra ◽  
Empirical Correlations ◽  
Normal Coordinate ◽  
Bond Lengths ◽  
Stretching Vibrations

The infrared and Raman spectra of M2[V2O2(O2)4(H2O)]·xH2O and M2[V2O2(O2)4(D2O)]·xD2O (M = N(CH3)4, Cs) were measured. In the region of the vanadium-oxygen stretching vibrations, the spectra were interpreted based on normal coordinate analysis, employing empirical correlations between the bond lengths and force constants.

Infrared and Raman Spectra, conformations,ab initio calculations and spectral assignments of 1,3-disilabutane (SiH3CH2SiH2CH3)

2007 ◽  
Vol 38 (9) ◽  
pp. 1159-1173 ◽  
Author(s):  
Gamil A. Guirgis ◽  
Paul M. Mazzone ◽  
Daniel N. Pasko ◽  
Peter Klaeboe ◽  
Anne Horn ◽  
...  
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Raman Spectra ◽  
Infrared And Raman Spectra

CONFORMATIONAL EQUILIBRIA IN OPEN-CHAIN α,β-UNSATURATED KETONES

1961 ◽  
Vol 39 (11) ◽  
pp. 2225-2235 ◽  
Author(s):  
K. Noack ◽  
R. Norman Jones
Keyword(s):  
Raman Spectra ◽  
Equilibrium Mixture ◽  
Infrared And Raman Spectra ◽  
Temperature Dependent ◽  
Trans Form ◽  
Open Chain ◽  
Unsaturated Ketones ◽  
Conformational Isomers ◽  
Alkyl Substitution ◽  
Conformational Equilibria

The infrared and Raman spectra of trans-Δ3-penten-2-one have been measured over the temperature range +30° to −75° and +85° to +5° respectively. The temperature-dependent changes observed in the spectra indicate that this ketone exists as an equilibrium mixture of s-cis and s-trans conformational isomers in the liquid state. The s-trans form is the more stable and is present exclusively in the crystalline solid.Similar measurements have been carried out on Δ3-buten-2-one. The infrared and Raman spectra of this ketone also exhibit temperature effects that can be explained by a similar equilibrium, though the evidence is not as conclusive as for trans-Δ3-penten-2-one.The influence of alkyl substitution at the α- and β-carbon atoms on the relative stability of the s-cis and s-trans forms of α,β-unsaturated ketones is discussed.

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