nitrogen-dioxide and nitrogen-pentoxide

Wet scrubbing combined with ozone oxidation has become a promising technology for simultaneous removal of SO2 and NOx in exhaust gas. In this paper, a new 20-species, 76-step detailed kinetic mechanism was proposed between O3 and NOx. The concentration of N2O5 was measured using an in-situ IR spectrometer. The numerical evaluation results kept good pace with both the public experiment results and our experiment results. Key reaction parameters for the generation of NO2 and N2O5 during the NO ozonation process were investigated by a numerical simulation method. The effect of temperature on producing NO2 was found to be negligible. To produce NO2, the optimal residence time was 1.25sec and the molar ratio of O3/NO about 1. For the generation of N2O5, the residence time should be about 8sec while the temperature of the exhaust gas should be strictly controlled and the molar ratio of O3/NO about 1.75. This study provided detailed investigations on the reaction parameters of ozonation of NOx by a numerical simulation method, and the results obtained should be helpful for the design and optimization of ozone oxidation combined with the wet flue gas desulfurization methods (WFGD) method for the removal of NOx.

Topics: Air Pollutants; Models, Theoretical; Nitric Oxide; Nitrogen Dioxide; Nitrogen Oxides; Oxidation-Reduction; Ozone; Vehicle Emissions

Uptake experiments of NO3 on mineral dust powder were carried out under continuous molecular flow conditions at 298 +/- 2 K using the thermal decomposition of N2O5 as NO3 source. In situ laser detection using resonance enhanced multiphoton ionization (REMPI) to specifically detect NO2 and NO in the presence of N2O5, NO3 and HNO3 was employed in addition to beam-sampling mass spectrometry. At [NO3] = (7.0 +/- 1.0) x 10(11) cm(-3) we found a steady state uptake coefficient gamma(ss) ranging from (3.4 +/- 1.6) x 10(-2) for natural limestone to (0.12 +/- 0.08) for Saharan Dust with gamma(ss) decreasing as [NO3] increased. NO3 adsorbed on mineral dust leads to uptake of NO2 in an Eley-Rideal mechanism that usually is not taken up in the absence of NO3. The disappearance of NO3 was in part accompanied by the formation of N2O5 and HNO3 in the presence of NO2. NO3 uptake performed on small amounts of Kaolinite and CaCO3 leads to formation of some N2O5 according to NO((3ads)) + NO(2(g)) --> N2O(5(ads)) --> N2O(5(g)). Slow formation of gas phase HNO3 on Kaolinite, CaCO3, Arizona Test Dust and natural limestone has also been observed and is clearly related to the presence of adsorbed water involved in the heterogeneous hydrolysis of N2O(5(ads)).

Topics: Air Pollutants; Atmosphere; Calcium Carbonate; Dust; Kaolin; Kinetics; Mass Spectrometry; Minerals; Nitrates; Nitrogen Dioxide; Nitrogen Oxides; Temperature; Time Factors

The reactions of gaseous dinitrogen pentoxide (N2O5) and nitrogen dioxide (NO2) with 1-palmitoyl-2-oleoyl-sn-glycerol-3-phosphocholine (POPC) coated on the inside surface of a glass reaction cell were studied at 298 K. Unsaturated phosphatidylcholines are significant components of pulmonary surfactant in the alveolar region of the lung and hence serve as a simple model to examine reactions of pulmonary surfactant with these oxidant air pollutants. Using high-performance liquid chromatography (HPLC), Fourier transform infrared and fast atom bombardment mass spectroscopy, the major products of reactions of POPC with N2O5 and NO2 were separated and identified. In the POPC-N2O5 reaction using either air or helium as a buffer gas, the nitronitrate, vinyl nitro and allylic nitro derivatives, as well as a small amount of the trans-isomer of the starting material, were obtained. The nature of the products obtained from the POPC-NO2 reaction depends on the concentration of NO2 as well as whether air is present. At low NO2 concentrations (PNO2/N2O4 less than or equal to 3.8 Torr) in air or in helium, the trans-isomer of POPC was formed almost exclusively. At higher NO2 concentrations (PNO2/N2O4 greater than or equal to 20 Torr) in helium, the dinitro, vinyl nitro and nitro alcohol derivatives were formed. In the presence of air (or 24% 18O2 in helium), a nitronitrate and a dinitronitrate were additional products. Mechanisms for the formation of the observed products and implications for the inhalation of oxides of nitrogen are discussed.

Topics: Chromatography, High Pressure Liquid; Fourier Analysis; Models, Biological; Nitrogen Dioxide; Nitrogen Oxides; Phosphatidylcholines; Pulmonary Surfactants; Spectrometry, Mass, Fast Atom Bombardment; Spectrophotometry, Infrared

The liquid lining of the alveolar region of the lung contains a surfactant which lowers the surface tension. The major active surface-tension-lowering compounds are phosphatidylcholines, some of which contain unsaturated fatty acid components. In order to determine whether these unsaturated moieties react with the gaseous air pollutant N2O5, which may be present in urban atmospheres at concentrations up to 15 ppb, phosphatidylcholines adsorbed on glass at 25 degrees C were exposed to mixtures of approximately 2 Toor (approximately 2600 ppm) N2O5 in 1 atm of air or argon in the gas phase. Nitronitrates were identified as products of the reactions of N2O5 with beta-oleoyl-gamma-palmitoyl L-alpha-phosphatidylcholine (OPPC) and dioleoyl L-alpha-phosphatidylcholine (DOPC) using Fourier transform infrared (FTIR) spectrometry and in the case of DOPC, fast atom bombardment mass spectrometry. FTIR studies also show that 2 Torr (approximately 2600 ppm) NO2 in 1 atm of air reacts with OPPC and DOPC to give new bands tentatively identified as nitronitrates. Finally, HNO3 was shown to react with OPPC, DOPC, and the saturated dipalmitoyl L-alpha-phosphatidylcholine to give products tentatively identified as nitrate salts and glycerol. These studies suggest that inhaled N2O5, if it reaches the alveolar region, is likely to react with unsaturated C = C groups in surfactant to form nitronitrates.

Topics: 1,2-Dipalmitoylphosphatidylcholine; Air Pollution; Chemical Phenomena; Chemistry; Fourier Analysis; Nitrogen Dioxide; Nitrogen Oxides; Phosphatidylcholines; Pulmonary Surfactants; Spectrophotometry, Infrared