• Journal of the Korean Chemical Society
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• v.22 no.1
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• pp.7-11
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• 1978

The reactions of 2,4-dinitroiodobenzene with para subtituted anilines in acetonitrile-methanol binary solvent mixtures have been studied. Rate constants for reactions in methanol rich solvents are greater than for reactions in acetonitrile rich solvents. Kinetic results show that the bond formation step is rate determining in the solvent system studied. The solvent effect can be explained by stabilization of the transition state by formation of hydrogen bond between oxygen atom of methanol and hydrogen atom of aniline.

• New & Renewable Energy
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• v.1 no.4 s.4
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• pp.19-24
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• 2005

수소 여과용 치밀질 membrane의 제조는 기존의 SC($SrCeO_3$)보다 높은 여과특성을 가지는 BC($BaCeO_3$)구조의 재료를 이용하여 시편을 제조하였고, 시편의 물성은 기공율, 수분에 대한 내구성 그리고 여과 특성을 측정하였다. 우선 열적 안정성 및 수분에 대한 내구성 향상은 $Y_2O_3$를 0.1mol첨가 하였을 때 1% 이내의 기공율을 가지고 있었으며 수분에 대한 안정성을 위해 boiling test에서도 균열이 발생되지 않고 안정적인 것을 확인할 수 있었다. 또한 여과 특성을 향상시키기 위해 Ce과 치환이 가능하고 전도성을 향상시킬 수 있는 $Ga_2O_3$, $La_2O_3$을 치환하여 물성을 측정한 결과 $Ga_2O_3$은 0.05, $La_2O_3$ 0.1mol%가 최적이었으며, 이들 중 $Ga_2O_3$가 0.05mol 첨가 되었을 때 가장 높은 이온 전도도 값을 얻었으며, $La_2O_3$이 첨가된 경우가 다음으로 높게 나타났다. 전자 전도성을 높이기 위하여 Pt를 sol로 만들어 나노 입자로 분산 시키는 방법으로 실험을 실시 $500^{\circ}C$ 이상의 온도에서는 복합전도에 의해 전도도가 향상되어지는 것을 확인할 수 있다. 또한 이들 시편의 여과 특성을 측정한 전도도 측정의 결과와 동일한 결과를 얻을 수 있었다.

• Proceedings of the Korean Radioactive Waste Society Conference
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• 2005.11a
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• pp.108-108
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• 2005

• Proceedings of the Korean Magnestics Society Conference
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• 1993.03a
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• pp.104-105
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• 1993

• Journal of the Korean Chemical Society
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• v.32 no.4
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• pp.301-310
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• 1988

Reaction rates for mononuclear heterocyclic rearrangement of N-(5-phenyl-1,2,4-oxadiazol-3-yl)-N'-arylformamidines into 3-acylamino-1-aryl-1,2,4-triazoles were determined spectrophotometrically in dioxane/water (50 : 50, v/v). There are two different reaction paths according to pH. One is pH-independent path, the other is pH-dependent one. In pH-independent path, the result of substituent effect by IYT equation show that N-H bond breaking as well as new N-N bond formation controls the reaction rate. In pH-dependent path, concave-upward Hammett plot was observed. It can be concluded that new N-N bond formation is more advanced than N-H bond breaking in transition state for electron-donating substituents, but N-H bond breaking is more advanced than new N-N bond formation for electron-withdrawing substituents.

• Journal of the Korean Chemical Society
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• v.55 no.3
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• pp.392-399
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• 2011

Two conformations of benzoic acid derivatives ($NH_2$, OH, H, F, Cl, CN, NO, $NO_2$) have been investigated at MP2, DFT and HF level using the 6-311++G(d,p) basis set. It was found that the cis isomers are more stable. Hydrogen bonding formation of benzoic acids has been estimated from stabilization energies. The calculated hydrogen-bonding energies of dimers showed a cooperative interaction in the cyclic ones. It was found that an electron-releasing group (ERG) into the phenyl rings resulted in the formation of more stable hydrogen bonding. Red shift of O-H bond was found from -565.3 to -589.3 for dimers. The natural bond orbital (NBO) analysis was applied to characterize nature of the interaction.

• Journal of the Korean Chemical Society
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• v.50 no.3
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• pp.183-189
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• 2006

A series of substituted styryl 4-methoxy-1-naphthyl ketones [(2E)-1-(4-methoxy-1-naphthyl)-3-phenyl-2-propen-1-ones] were synthesized using facile method of microwave assisted condensation reaction. The yield of chalcones is more than 90%. They are characterized by their physical constants, micro analysis, infrared (KBr, 4000-400 cm？1) and NMR both 1H and 13C spectral data. From infrared spectra, the s-cis and s-trans stretching vibrations of carbonyl group, from NMR spectra the ethylenic proton and carbon chemical shifts (ppm) are assigned. These spectral data are correlated with various Hammett substituent constants. From the results of statistical analysis the effect of substituents on CO, ？ and ？ proton and carbons are explained.

• Proceedings of the Korea Air Pollution Research Association Conference
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• 1999.10a
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• pp.94-95
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• 1999

불소나 염소가 수소대신에 치환 되어있는 활로겐화 화합물인 염화불화탄화수소(CFCs chlorofluoro carbons)는 오존층 파괴물질 그리고 지구온난화 기체물질로 널리 알려져있다. 이러한 CFCs는 Mauna Loa, Niwot Ridge, South Pole과 같은 지구배경농도지역에서 70년대 후반부터 지속적으로 측정되어 오고 있다. 대기중 CFCs농도는 일반적으로 수백 ppt 수준으로 매우낮아 측정이 매우 어려운 것으로 알려져왔다.(중략)

• Polymer(Korea)
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• v.35 no.6
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• pp.505-512
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• 2011

Effects of structural features of 4 dinuclear constrained geometry catalysts having paraxylene derivative bridge (DCGC) on copolymerization of ethylene and 1-hexene were investigated. The bridges of three catalysts have para-xylene backbone with a different substituent at benzene ring. The substituents were hydrogen (Catalyst 1), isopropyl (Catalyst 2), n-hexyl (Catalyst 3) and 1-octyl (Catalyst 4). It was found that Catalyst 1 having hydrogen as a substituent exhibited the greatest activity among the four dinuclear CGCs. On the other hand, Catalyst 2 containing isopropyl as a substituent showed the smallest activity. Very interestingly, Catalyst 2 was able to produce about 6 times higher molecular weight polymer than Catalyst 3 and 4. Catalyst 3 and 4 having a long alkyl chain substituent revealed the biggest comonomer response to generate polyethylene copolymer containing more than 40% 1-hexene contents. These results suggest that the control of the substituent of para-xylene bridge of dinuclear CGC can provide a proper method to adjust the microstructure of polyethylene copolymers.

• Journal of the Korean Chemical Society
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• v.33 no.6
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• pp.623-632
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• 1989

The positions and interaction energies of framework atoms and water molecules of $Mn^{2+}$-exchanged zeolite A were calculated using some potential energy functions and an optimization program. The sum of interaction energies of framework atoms in dehydrated $Mn_{4,5}Na_3-A$ was approximately the same as those of thermally stable $Ca^{2+}$-or $Mg^{2+}$-exchanged zeolite A. Since $Mn^{2+}$ ions can form good coordination bonds with framework oxygens even in dehydrated state, $Mn^{2+}$-exchanged zeolite A is considered to be thermally stable. The optimized positions of framework atoms and ions in this work are agreed well with the crystallographic data. Three groups of water molecules are found in hydrated $Mn^{2+}$-exchanged zeolite A; W(I) group of water molecules having only hydrogen bonds, W(II) group coordinated to $Na^+$ ion, and W(III) group coordinated to $Mn^{2+}$ ion. The average binding energy of each group of water molecules decrease in the order of W(III) > W(II) > W(I). The activation energies in the dehydration reaction of each group of water molecules increased in accordance with their binding energy.