• 한국염색가공학회지
• /
• 제7권4호
• /
• pp.8-15
• /
• 1995

A series of thermotropic Polyurethanes mesogenic unit were synthesized by polyaddition of a para-type diisocyanate such as 2,5-tolylene diisocyanate(2,5-TDI) with 4-4'-bis($\omega$-hydroxyalkoxy) biphenls(BPm: $HOCmH_{2m}OC_{6}H_{4}OC_{m}H_{2m}OH$ : m is the carbon number of the hydroxyalkoxy group) in DMF. Intrinsic viscosities of the polymers were in the range of 0.41~0.99dL/g DSC thermograms for these polymers exhibited two endothermic peaks corresponding to phase transitions of melting and isotropization. For examplem polyurethane 2,5-TDI/BPll with [η]=0.99 prepared from 2.5-TDI and 4,4'-bis[11-hydroxyundecaoxy biphenyl(BP11) a liquid crystalline phase from 156 to 173$^{\circ}C$. The thermotropic properites of liquid crystalline polyurethanes have been investigated by wide-angle X-ray scatter(WAXS), infrared (IR) spectroscopy, and differential scanning calorimetry (DSC). The mesomorphic behavior of the polyurethanes was concluded to be greatly dependent on the intermolecular hydrogen bonds through the urethane.

• 폴리머
• /
• 제25권5호
• /
• pp.649-656
• /
• 2001

비닐아세테이트-비닐알핀을 (VAc-VAL) 공중합체의 조성에 따른 폴리(4-비닐피리딘)(P4VP)/VAc-VAL 공중합체 블렌드의 상용성을 조사하였다. 블렌드 시료의 시차 주사 열분석(DSC0 및 광학현미경에 의한 상분리온도 조사(TOM)를 통하여 P4VP는 VAL의 조성이 30 mole% 이상 함유된 VAc-VAL 공중합체들과 상용성이 있음이 확인되었다. 상용성 P4VP/Vac-VAL 공중합체 블렌드의 푸리에 변환 적외선(FT-IR) 분광 분석 결과 비닐피리딘과 비닐알코올 히드록실기 상에 강한 분자간 수소결합이 형성됨을 확인하였다. 성분 고분자 사이에 분자간 수소결합에 의해서 고분자 블렌드의 상용성이 유도되는 고분자 블렌드계의 열역학적 모델인 Association 모델을 이용하여 P4VP/VAc-VAL 공중합체 블렌드의 이론적인 상 그림을 구하였다. 이론적으로 계산된 binodal 곡선을 실험적으로 구한 흐림점 생성 곡서과 잘 일치하는 결과를 보였다.

• Coupled systems mechanics
• /
• 제6권3호
• /
• pp.369-376
• /
• 2017

Intermolecular interaction energies and conformer geometries of the hydrogen bonded acrylamide dimers have been studied by using the second-order Møller-Plesset (MP2) perturbation theory and the density functional theory (DFT) with 17 density functionals. Dunning's correlation consistent basis sets (up to aug-cc-pVTZ) have been used to study the basis set effects. The DFT calculated interaction energies are compared to the reference energy data calculated by the MP2 method and the coupled cluster method at the complete basis set (CCSD(T)/CBS) limit in order to determine the relative performance of the studied density functionals. Overall, dispersion-energy-corrected density functionals outperform uncorrected ones. The ${\omega}B97XD$ density functional is particularly effective in terms of both accuracy and computational cost in estimating the reference energy values using small basis sets and is highly recommended for similar calculations for larger systems.

• Macromolecular Research
• /
• 제15권7호
• /
• pp.605-609
• /
• 2007

The molecular interactions of polyacrylonitrile (PAN) and cellulose acetate (CA) were investigated thoroughly via dilute solution viscometry in dimethylformamide (DMF) as a common solvent at $30^{\circ}C$. The intrinsic viscosities and viscometric interaction parameters were experimentally determined for both binary (polymer/dimethylformamide) and ternary (PAN/CA/dimethylformamide) systems. As all investigated PAN/CA ternaries evidenced negative viscometric interaction parameter values $({\Delta}b\;&{\Delta}k<0)$, the existence of repulsive intermolecular interactions was deduced, and PAN/CA blends were assigned as immiscible. Moreover, the results of microscopy photograph analysis indicated that pure PAN film evidences a homophasic structure, and the size of the phase domain increases gradually with increases in CA. In DSC analysis, it was determined that the glass transition temperature of the blend film increased slightly with increases in the CA content of the blend film.

• 대한전기학회:학술대회논문집
• /
• 대한전기학회 2000년도 하계학술대회 논문집 C
• /
• pp.1708-1710
• /
• 2000

The synthesis and characterization of polymers for organic Metal/Insulator/Metal(MIM) devices were investigated from LB films. The physicochemical properties of the LB films were examined by UV absorption spectrum and AFM. The AFM images showed for network structure of polyurethane monolayer that the film formed an unsymmetry mesh with intermolecular interaction within the large scale. The stable images are probably due to a strong interaction between the monolayer film and Si substrate. We are unable to obtain molecular resolution in images of the films but did see a marked contrast between images of the bare substrate and those with the network structure film deposited onto it.

• Bulletin of the Korean Chemical Society
• /
• 제3권2호
• /
• pp.37-44
• /
• 1982

In this work we have studied the multilayer stepwise adsorption of gases on solid adsorbents based on the previously developed theory. It is shown that stepwise adsorption isotherms emerge from our theory if an ad hoc adsorption regarding the degree of occupation for each successive layer is abolished and the effect of lateral intermolecular interactions among adsorbate molecules is included. In addition to these the effect of vertical interactions has also been taken into consideration. It seems that the vertical interaction plays a role in deciding the shape and the position of steps in resulting isotherms. It is evident from this research that it is the lateral interaction that is responsible for stepwise adsorption as long as the adsorbent surface is uniform and temperature is sufficiently low.

• Bulletin of the Korean Chemical Society
• /
• 제10권2호
• /
• pp.138-142
• /
• 1989

Three oxovanadium(IV) complexes with bidentate ligands having only oxygen donor atoms, benzohydroxamic acid (Hben), 8-hydroxyquinoline-N-oxide(Hhqno) and picolinic acid-N-oxide (Hpicn) are prepared and magnetic and spectroscopic properties are investigated for the complexes $VO(ben)_2,\;VO(hqno)_2\;and \;VO(picn)_2.$ Magnetic data together with IR results strongly indicate that dimeric intermolecular interaction is significant in $VO(ben)_2$ while the presence of polymeric V-O${\cdot}{\cdot}$V-O interaction is suggestive in $VO(picn)_2$. For all three complexes, three electronic d-d transitions were observed; extremely strong optical absorption of these bands of $VO(ben)_2$ in DMSO are supposed to be arised from a great metal-ligand covalency. Some fundamental vibration modes of oxovanadium(IV) complexes were empirically assigned from the differences in the spectrum of metal complexes with free ligand.

• 한국자기공명학회논문지
• /
• 제22권4호
• /
• pp.76-81
• /
• 2018

Investigation of the protein-protein interaction mode at atomic resolution is essential for understanding on the underlying functional mechanisms of proteins as well as for discovering druggable compounds blocking deleteriou interprotein interactions. Solution NMR spectroscopy provides accurate and precise information on intermolecular interactions even for weak and transient interactions, and it is also markedly useful for examining the change in the conformation and dynamics of target proteins upon binding events. In this mini-review, we comprehensively describe three unique and powerful methods of solution NMR spectroscopy, paramagnetic relaxation enhancement (PRE), pseudo-contact shift (PCS), and residual dipolar coupling (RDC), for the study on protein-protein interactions.

• 공업화학
• /
• 제9권2호
• /
• pp.185-192
• /
• 1998

네 종류의 폴리아믹산(PPA)은 서로 다른 구조의 디아민들인 3,3'-diaminodiphenyl sulfone(3,3'-$DDSO_2$), 4,4'-diarrinodiphenyl sulfone(4,4'-$DDSO_2$), 4,4'-methylene dianiline(4,4'-MDA) 및 4,4'-oxydianiline(4,4'-ODA)와 디안하이드라이드인 3,3', 4,4'-benzophenone tetracarboxylic dianhydride (BTDA)를 용매인 DMAc를 이용하여 합성되었다. 이들의 폴리아믹산(PAA)을 이용하여 poly[2,2-(m-phenylene)-5,5'-bibenzimidazole](PBI)와 용액 블렌딩하여 Blend-I, II, III, 그리고 IV로 칭하였으며, 이에 대한 시료를 필름이나 분말로 제조한 PBI/PAA 시스템을 예상된 $T_g$보다 높은 온도에서 열경화시켜 PBI/PI 블렌드로 전환시킨후 PI 합성시 사용된 디아민의 분자구조 변화에 따른 블렌드의 상용성과 그 상호작용의 상대적인 세기를 살폈다. 이로부터 본 연구에서 이용된 네 개의 블렌드들은 상용성을 보였으며, 이들 상용성을 가져다주는 상호작용의 세기는 Blend-III와 Blend-IV가 Blend-I와 Blend-II보다 큼을 보였다. 이와 같이 블렌드에 사용된 PI의 구조변화에 따라 상호작용이 다른 것은 PI합성시에 사용된 디아민의 구조에서 페닐링 사이에 존재하는 linkage인 O나 $CH_2$보다는 $SO_2$가 존재할 때 블렌드를 이루는 두 고분자사이의 상호작용인 수소결합력을 약화시키는 spacer로 작용하였다고 판단된다.

• Rapid Communication in Photoscience
• /
• 제4권1호
• /
• pp.1-8
• /
• 2015

For understanding molecular mechanisms of photochemical reactions, in particular reactions of proteins with biological functions, it is important to elucidate both the initial reactions from the photoexcited states and the series of subsequent chemical reactions, e.g., conformation, intermolecular interactions (hydrogen bonding, hydrophobic interactions), and inter-protein interactions (oligomer formation, dissociation reactions). Although time-resolved detection of such dynamics is essential, these dynamics have been very difficult to track by traditional spectroscopic techniques. Here, relatively new approaches for probing the dynamics of protein photochemical reactions using time-resolved transient grating (TG) are reviewed. By using this method, a variety of spectrally silent dynamics can be detected and such data provide a valuable description about the reaction scheme. Herein, a blue light sensor protein TePixD is the exemplar. The initial photochemistry for TePixD occurs around the chromophore and is detected readily by light absorption, but subsequent reactions are spectrally silent. The TG experiments revealed conformational changes and changes in inter-protein interactions, which are essential for TePixD function. The TG experiments also showed the importance of fluctuations of the intermediates as the driving force of the reaction. This technique is complementary to optical absorption detection methods. The TG signal contains a variety of unique information, which is difficult to obtain by other methods. The advantages and methods for signal analyses are described in detail in this review.