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191.
192.
193.
Excitation energies of 123 polycyclic aromatic hydrocarbons were calculated by incorporating the improved method of new-γ for the two-center electron repulsion integral into two semiempirical molecular orbital methods (CNDO/S and INDO/S). This variable method well reproduced experimental excitation energies of them. The average error of the improvement is about 0.162 (CNDO/S) or 0.237 eV (INDO/S) though the average error without the improvement is about 0.541 (CNDO/S) or 0.536 eV (INDO/S). The improvement was useful for the calculations of other organic compounds including hetero atoms, such as organic dye. 相似文献
194.
Kinetics of chemiluminescence reactions of 2-methyl-6-phenylimidazo[1,2-a]pyrazin-3(7H)-one (1c, Cypridina luciferin analogue) and substituent effects of the 6-aryl group of derivatives 1 strongly suggest that the rate-determining step is a single electron transfer from an anion derived from 1 to a triplet molecular oxygen (O2) in the oxygenation process. 相似文献
195.
196.
R. Winkler J. Wilhelm M. Capitelli C. Gorse 《Plasma Chemistry and Plasma Processing》1992,12(1):71-87
Calculations of the electron energy distribution and of relevant macroscopic quantities of collision-dominated, weakly ionized plasmas under rf field action have been performed with increasing degrees of ionization, and the impact of the electron-electron interaction on these quantities was determined. The investigations were performed for the gas plasmas in CO and H2 as representatives of molecular plasmas The energy distribution and macroscopic quantities are obtained by solving the nonstationary Bolizmann equation for a given rf field and degree of ionization taking into accoung and additional Fokker-Planck term besides the collision integrals for the elastic and the main inelastic collision processes. In these molecular plasmas a remarkable impact of the electron-electron interaction connected with increasing Maxwellization is observed for degrees of ionization greater than 10. 相似文献
197.
Tadafumi Shindo Toshiyuki Uryu 《Journal of polymer science. Part A, Polymer chemistry》1992,30(3):363-370
Solid-state polymerization of a binary mixture of nonliquid-crystalline monomer and liquidcrystalline compound was carried out using electron beam. The monomers were benzoic acid containing 4-[ω-(meth)acryloyloxyalkyloxy] benzoic acids, in which the alkylene spacer was ethylene, hexamethylene, or undecamethylene. The conversion yield of monomer to polymer to a large extent increased with increasing content of a liquid-crystalline compound with a terminal carboxylic group, such as 4-n-alkyloxybenzoic acid, while the addition of a liquid-crystalline compound without terminal carboxylic group did not affect polymerization of the monomer. Phase diagrams of the mixture of monomer and liquid-crystalline compound were examined using cross-polarizing microscopy and differential scanning calorimetry (DSC). All mixtures of monomer and 4-n-alkyloxybenzoic acid or liquid-crystalline compound without terminal carboxylic group showed liquid-crystallinity in a broad composition range. It was concluded that liquid-crystalline compounds with terminal carboxylic acid may form hydrogen bondings with methacrylate or acrylate monomer having terminal carboxylic acid which enhance polymerizability of the mixture. The stereoregularity of polymers determined by NMR depended on increasing irradiation dose and temperature rather than the content of the added liquid-crystalline 4-n-decanoxybenzoic acid. 相似文献
198.
微波消解-火焰原子吸收光谱法测定兰州鲶中微量元素 总被引:3,自引:0,他引:3
使用微波消解处理样品,火焰原子吸收光谱法测定了兰州鲶中的铁、锌、镁含量。结果显示,兰州鲶中含有丰富的铁、锌、镁三种人体必需微量元素。该法测定快速、简单,结果满意。 相似文献
199.
Diamy A.-M. Hochard L. Legrand J.-C. Ricard A. 《Plasma Chemistry and Plasma Processing》1998,18(4):447-460
Measurements of nitrogen atom density, by means of NO chemical titration, along with an evaluation of the densities of some excited species N
2
(B, v=11), N
2
(B, v=2), N
2
(C, v=0), and N
2
+
(B,v=0), by means of a spectroscopic study of some bands of dinitrogen, are achieved along the flowing afterglow of a dinitrogen microwave plasma (2450 MHz) for several pressures. The concentrations obtained are in the following range: [N]10
+15
, [N
2
(B, 2)]10
+9
–10
+10
, [N
2
(B, 11)]10
+8
–10
+9
, [N
2
(C, 0)]10
+6
–10
+7
, [N
2
+
(B,0)]10
+6
-10
+8
(cm-3). From a kinetic study of the formation and decay of excited and charged species, an estimation of N
2
(A, v), N
2
(X, v, and N
2
+
(X) densities can be derived: [N
2
(A, v)]10
+12
, [N
2
(X, v6)]10
+15
–10
+16
, [N
2
(X, v12)]10
+14
–10
+15
, [N
2
+
(X)]10
+10
(cm
-3
). 相似文献
200.
A polyphosphide of the type (NaP)X 1 was obtained from red phosphorus and sodium in presence of small amounts of naphthalene in 1,2-dimethoxyethane as solvent. 1 reacts with alkyl halides in dependence on the kind of alkyl group with formation of different alkylcyclophosphanes. As definite compounds Me5P5 2 , Et5P5 3 (with not definite constitution), i-Pr4P4 4 and t-Bu4P4 5 could be isolated. 1 was identified by X-ray diffraction, 2 – 5 by means of their 1H, 13C, 31P n.m.r. and mass spectra. The molecular structure of 4 was identified by electron diffraction. 相似文献