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1.
G. Balducci L. Bencivenni G. De Rosa R. Gigli B. Martine S.Nunziante Cesaro 《Journal of Molecular Structure》1980
The infrared and Raman spectra of some cyclopentadienyl compounds of the transition metals, namely Ti(C5H5)Cl3 and M(C5H5)2Cl2 (M = Ti, Zr and Hf), are reported and discussed. The infrared spectra of the gaseous species isolated in argon matrices at 10 K provide structural information about the single molecules. Particular attention has been paid to the low-frequency region in order to achieve more reliable assignments for the internal-rotation modes. The structural data and the fundamental frequencies derived from the spectra are employed in a calculation of the thermodynamic functions for these compounds in the ideal gas state. 相似文献
2.
M. G. Ezernitskaya B. V. Lokshin T. Yu. Orlova V. N. Setkina V. I. Shilnikov S. Nunziante Cesaro 《Russian Chemical Bulletin》1994,43(11):1841-1845
FTIR spectra have been studied for staircase cyclopentadienyl complexes containing two or three metal carbonyl fragments bound by the metal-carbon bond Cp(CO)2Fe-CpmMn(CO)3 (1), Cp(CO)2Fe-CpmFe(CO)2CH2Ph (2), Cp(CO)2Fe-Cpm(CO)2Fe-CpmMn(CO)3 (3), Cp(CO)2Mo-Cpm(CO)2Fe-CpmMn(CO)3 (4), Cp(CO)3W-Cpm(CO)2Fe-CpmMn(CO)3 (5), Cp(CO)2Fe-Cpm(CO)2Fe-BmCr(CO)3 (6), Cr(CO)3Bm-CpmFe(CO)2CH2Ph (7), where Cp = 5-C5H5, Cpm = 15-C5H4, Bm = 16-C6H5. Temperature-dependent FTIR spectra were measured inn-pentane solutions over a wide temperature range and in the low-temperature solid matrices of argon and nitrogen. Rotamers, formed due to rotation about the metal-carbon -bond, were found in solutions and matrices. A molecular mechanics calculation of1 proved the possibility of such rotation.Translated fromIzyestiya Akademii Nauk. Seriya Khimicheskaya, No. 11, pp. 1952–1956, November, 1994.The authors are grateful to the Russian Foundation for Basic Research (project code No 93-03-18592) and to the International Science Foundation (project code No MEQ000). 相似文献
3.
The polarisation behaviour of the infrared absorptions of a single crystal of bis-(dimethyldithiophosphato) nickel(II) with (001) as the predominant face is studied. Because only a and b polarisation can be measured on (001), the b2u and b3u normal modes, which are polarised on b, cannot be distinguished, whilst the b1u modes are observed on a. The most characteristic absorptions of the compound are assigned on the basis of the polarisation results. The comparison of the crystal with the solution spectrum indicates that the absorptions at 396 and 357 cm?1 undergo crystal field splitting in the solid. 相似文献
4.
The thermal properties of cobalt(II) and copper(II) complexes of saccharin (sacc) (o-benzoic sulfimide) have been studied, and are compared with those of ternary complexes of cobalt(II) and copper(II) having both saccharin and pyridine as ligands. The thermal behaviour is discussed in terms of the bonds between the central ion and the ligands. The frequency shifts of the carbonyl and sulfonyl groups support the hypotheses derived from the thermal data. The thermal stability scale CO(II) /s> Cu(II) is always obtained while the stability constant scale is CO(II) < Cu(II). 相似文献
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We have measured the infrared spectrum of pentafluoroethyl chloride in cryogenic matrices of argon, nitrogen, krypton, and xenon from 880 to 1360 cm?1. Numerous combination bands were observed; assignments and symmetries are reported for most. Appreciably more structure was observed in argon than in other matrices. The observed splitting of the fundamental bands in an argon matrix into two or more components may be due to multiple trapping sites. 相似文献
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The reaction of magnesium and oxygen atoms in argon, krypton, xenon and oxygen matrices at 20.4° K was studied by infrared spectroscopy between 200 and 4000 cm?1. The appearance of a band in the magnesium-oxygen stretching region, reproducible in all the matrices, indicates that reaction takes place. Oxygen-13 isotopic substitution suggests that the absorption is due to Mg3O3, whose formation is supported by the crystal structure of the solid phase. The force constants are calculated as fR = 2.3 mdyne/Å and F?/R2 = 0.44 mdyne/Å assuming a planar six-membered ring of alternate magnesium and oxygen atoms with bond angles O-Mg-O 100° and Mg-O-Mg 140°. 相似文献
9.
L. Bencivenni A. Farina S.Nunziante Cesaro R. Teghil M. Spoliti 《Journal of Molecular Structure》1980
The IR and Raman spectra of gaseous and solid CH3TiX3 and CD3TiX3 species (X = Cl, Br, I) are reported. The gas phase spectra have been recorded between 4000 and 20 cm?1 at pressures of 1 atm and 4 atm at 350 K and the Raman spectra of the solid phase recorded at 4.2 K. Internal rotation barriers and thermodynamic functions have been calculated. 相似文献
10.
R. Teghil L. Bencivenni S.Nunziante Cesaro Á. Szabó M. Spoliti M. Maltese 《Journal of Molecular Structure》1981,73(1):15-17
The IR spectra of vapour from a Na3PO4, Na5P3O10 and Na2O-P2O5, mixture have been obtained in solid nitrogen at 12 K. The results suggest that it is possible to isolate both NaPO3 and NaPO2 when sodium tripolyphosphate and the Na2O-P2O5 mixture are vaporized. There was no evidence of the NaPO molecule, reported to be one of the most abundant vapour species in mass-spectrometric work on the vaporization of Na5P3O10. 相似文献