Decomposition of formic acid over V-Ti-O catalysts was studied by in situ IR spectroscopy. Four surface compounds, among which are H-bonded acid, one mono- and two bidentate formates (BF1 and BF2), were identified in the temperature range of 100-190°C. The activation energy and rate of the BF2 decomposition were found equal to those for the CO formation. This equality points to the involvement of BF2 in the HCOOH decomposition into carbon monoxide. 相似文献
Mixed dialkytin(IV) trifluoroacetates,Me EtSn(O2CCF3)2,Et PrnSn(O2CCF3)2 andPrnBunSn(O2CCF3)2 have been prepared by metathetical reactions of the corresponding dialkyltin(IV) chlorides with silver trifluoroacetate in CH2Cl2. They are monomeric in benzene and nonconducting inMeNO2 andMeCN. Bidentate trifluoroacetate groups are indicated by their IR spectra.Mössbauer spectra confirmtrans-arrangement of theR-Sn-R moiety.1H,19F NMR and mass spectra are also discussed.
Gemischte Dialkylzinn(IV)-trifluoracetate
Zusammenfassung Die gemischten Dialkylzinn(IV)-trifluoroacetateMe EtSn(O2CCF3)2,Et PrnSn(O2CCF3)2 undPrnBunSn(O2CCF3)2 wurden über Metathese-Reaktionen der entsprechenden Dialkylzinn(IV)-chloride mit Silbertrifluoracetat in CH2Cl2 dargestellt. Sie sind monomer in Benzol und nichtleitend inMeNO2 undMeCN. Die IR-Spektren zeigen zweizähnige Trifluoracetat-Gruppen an. DieMössbauer-Spektren bestätigen dietrans-Anordnung derR-Sn-R-Einheit. Die1H-,19F-NMR und die Massenspektren werden ebenfalls diskutiert.
Alkali metal salts of acrylamide C3H4NOM (M = Li, Na, and K) were synthesized for the first time by metallation of acrylamide with alkali metals, their alkyl derivatives, or hydrides. The structures of the compounds synthesized were studied by Raman and IR spectroscopy. Based on the results obtained, an ionic structure was proposed for the salts. The salts were tested as initiators of the anionic polymerization of acrylamide. The catalytic activity of C3H4NOM in the polymerization of acrylamide is not lower than that of the well known catalyst, KOBu1.Translated fromIzvestiya Akademii Nauk. Seriya Khimicheskaya, No. 9, pp. 2316–2319, September, 1996. 相似文献
The geometry of the 4′-cyano-(4′-CNPTB) and the 4′-methoxy-(4′-MePTB) phenylthiolbenzoates were obtained by ab initio calculations
employing 6–31G basis set at Hartee-Fock level of theory. The results predict an extended form of the molecules and torsional
angle between the phenyl rings at 90.85(6)0 and 90.87(3)0, respectively. On the basis of vibrational analysis the frequency assignment was carried out. The calculated frequencies
were compared with the experimental IR spectral data in carbon tetrachloride, carbon disulfide solutions and in solid state. 相似文献
Halfsandwich Complexes of Chromium with the Trifluoromethyl Isocyanide Ligand The synthesis and properties of the halfsandwich complexes [η6-1,3,5-C6H3(CH3)3]Cr(CO)2(CNCF3), [η6-1,3,5-C6H3(CH3)3]Cr(CO)(CNCH3)(CNCF3) und [η6-1,3,5-C6H3(CH3)3]Cr(CNCF3)3 is reported. The vibrational spectroscopic data proof the strong π accepting character of the trifluoromethyl isocyanide ligand. 相似文献
IR spectroscopy was coupled with the matrix isolation technique to study the molecular complex formed between C3O2 and HCl and its photodissociation. The vibrational frequencies of the complex were compared with those of HCl and C3O2 monomers. For C3O2, a bent structure was characterized in the solid environment.
The vibrational frequencies were calculated in the 4000–400 cm−1 range using an ab initio method at the MP2/6-31G** level for the most stable complex; these frequencies describe the hydrogen interaction with the central carbon atom of C3O2 (T complex). The measured shifts between the vibrational mode frequencies of the complex and monomers were in good agreement with the calculated values.
Broad-band UV irradiation ( > 230 nm) of the T complex leads preferentially to ketene chloride and carbon monoxide. Ketene chloride formation can be explained by the reaction between HCl and the carbene C2O, which results from photo-dissociation at the C=CO bond of C3O2. 相似文献
Hydroxyapatite (HAp) was modified by the action of various hydrophobic agents based on silicon-containing compounds. The influence of the type of applied agent on the thermodynamic and kinetic parameters of the cross-linking of poly(dimethyl siloxane)/HAp composites was investigated. All the modified HAp particles became hydrophobic and these samples were used to synthesize the polysiloxane/hydroxyapatite composites (PDMS/HAp). The possible modes of interaction between the hydroxyapatite and hydrophobing agents were discussed. The most probable interaction between hydroxyapatite and the applied hydrophobing agents is hydrogen bonding. PDMS/HAp composites were formed directly in the cell of the DSC and cross-linking was investigated in situ. It was determined that the introduction of hydroxyapatite into polysiloxane matrices changed the enthalpy of cross-linking, as well as the activation energy of cross-linking and reaction order, while the introduction of modified HAp led to thermodynamic and kinetic parameters more similar to those of the cross-linking of unfilled elastomer. 相似文献
Four new clathrates of the formula M(Im)2Ni(CN)4·2·Dioxane (where M = Co, Ni, Cu, Cd; Im = Imidazole) have been prepared in powder form and their FT-IR and laser-Raman spectra are reported for the first time. These clathrates are analogues to the previously reported classical Hofmann type clathrates except for the copper clathrate. The Cu clathrate has different spectral features in comparison with its analogues due to the Jahn-Teller effect. 相似文献