• 제목/요약/키워드: Three center two electron bond

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Synthesis and Structural Characterization of Novel Organohydroborate Hafnocene Complex (η5-C5H5)2Hf{(μ-H)2BC8H14)}Cl

  • Chung, Jang-Hoon;Lee, Sang-Mock
    • Bulletin of the Korean Chemical Society
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    • 제27권5호
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    • pp.759-761
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    • 2006
  • The compound B(C6F5)3 and its variations have been widely employed as alkyl carbanion abstracting reagents to produce metallocene cations for olefin polymerization.1-3 Weakly coordinating anions containing boron can greatly improve the activity of metallocene catalysts used in industrial olefin polymerization4 and thus group IV and V metallocene complexes of the organohydroborate anions have been intensively investigated.5 Recently, many organohydroborate metallocene complexes have been reported by Shore and co-workers.6-8 A common structural feature of those complexes is the three-center two electron M-H-B bond, like that observed in transition metal tetrahydroborate complexes but the reactivity and fluxional behavior of organohydroborate complexes are unlike those of the tetrahydroborate analogues.6 Although many of those metallocenes have been synthesized, few complexes could be used in the olefin polymerization and then this laboratory has been involved in the chemistry of the cyclic organohydroborate anions, and their group IV metallocene derivatives for the catalyst.9 Described here is recent work that led to the preparation of a novel cyclic organohydroborate hafnocene complex (h5-C5H5)2Hf ?(μ-H)2BC8H14 ,Cl. The hafnocene complex contains the three-center two electron bond Hf-H-B10 in which the hydride abstraction for olefin polymerization may occur.

The effect of a desensitizer and $CO_2$ laser irradiation on bond performance between eroded dentin and resin composite

  • Ding, Meng;Shin, Sang-Wan;Kim, Min-Soo;Ryu, Jae-Jun;Lee, Jeong-Yol
    • The Journal of Advanced Prosthodontics
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    • 제6권3호
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    • pp.165-170
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    • 2014
  • PURPOSE. This study was aimed to evaluate effect of the desensitizing pretreatments on the micro-tensile bond strengths (${\mu}TBS$) to eroded dentin and sound dentin. MATERIALS AND METHODS. Forty-two extracted molars were prepared to form a flat dentin surface, and then they were divided into two groups. Group I was stored in distilled water while group II was subjected to a pH cycling. Each group was then subdivided into three subgroups according to desensitizing pretreatment used: a) pretreatment with desensitizer (Gluma); b) pretreatment with $CO_2$ Laser (Ultra Dream Pluse); c) without any pretreatment. All prepared surfaces were bonded with Single Bond 2 and built up with resin composite (Filtek Z250). The micro-tensile bond test was performed. Fracture modes were evaluated by stereomicroscopy. Pretreated surfaces and bonded interfaces were characterized by scanning electron microscope (SEM). The data obtained was analyzed by two-way ANOVA (${\alpha}$=0.05). RESULTS. For both sound and eroded dentin, samples treated with desensitizer showed the greatest ${\mu}TBS$, followed by samples without any treatment. And samples treated with $CO_2$ laser showed the lowest ${\mu}TBS$. SEM study indicated that teeth with eroded dentin appeared prone to debonding, as demonstrated by existence of large gaps between adhesive layers and dentin. CONCLUSION. Pretreatment with Gluma increased the ${\mu}TBS$ of Single Bond 2 for eroded and sound teeth. $CO_2$ laser irradiation weakened bond performance for sound teeth but had no effect on eroded teeth.

3종 시멘트로 접착한 소아용 기성 지르코니아 전장관과 유치 상아질의 전단결합강도 (Shear Bonding Strength of Three Cements Luted on Pediatric Zirconia Crowns and Dentin of Primary Teeth)

  • 이정은;박호원;이주현;서현우
    • 대한소아치과학회지
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    • 제45권3호
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    • pp.314-323
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    • 2018
  • 이 연구의 목적은 3종 시멘트의 전단결합강도를 평가하고 열순환 시행이 전단결합강도에 미치는 영향을 알아보고자 한다. 소아치과에서 사용되는 소아용 기성 지르코니아 전장관($NuSmile^{(R)}$ ZR crown)의 내면과 유사한 디스크 형태의 지르코니아 시편(Zirconia discs)을 제작하였다. 소아용 기성 지르코니아 전장관의 내면과 지르코니아 시편의 표면이 동일하도록 같은 몰드를 이용하여 제작하였으며 주사전자현미경을 통해 유사함을 확인하였다. 60개의 지르코니아 시편과 60개의 유구치 상아질 시편을 3종의 시멘트 $Ketac^{TM}$ Cem Permanent Glass Ionomer Luting Cement(KGI), $RelyX^{TM}$ Luting Plus Cement(RLP), $RelyX^{TM}$ Unicem Self-Adhesive Universal Resin Cement(RUR)에 따라 20개씩 나누고, 열순환 시행 유무에 따라 다시 10개씩 2개의 하위그룹으로 나누었다. 하위그룹 A는 열순환을 시행하지 않았고 하위그룹 B는 5500회의 열순환을 시행하였다. 만능 재료 시험기를 이용하여 전단결합강도를 측정한 후 파절 양상을 주사전사현미경으로 관찰하였다. 지르코니아 시편 및 유구치 상아질 시편에 접착한 시멘트의 전단결합강도는 RUR이 KGI와 RLP보다 높았으며 통계적으로 유의한 차이가 관찰되었다(p < 0.05). RUR의 전단결합강도는 열순환 시행하지 않은 군과 열순환 시행한 군 사이에 통계적으로 유의한 차이가 없었다.

치질에 대한 상아질 접착제의 접합도에 관한 연구 (A STUDY ON THE ADAPTATION OF DENTIN BONDING AGENTS TO TOOTH STRUCTURE)

  • 박성택;조영곤;황호길
    • Restorative Dentistry and Endodontics
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    • 제20권2호
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    • pp.732-743
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    • 1995
  • The purpose of this study was to evaluate the adaptation of light cured dentin bonding agents to tooth structure by measuring contraction gaps on interfaces between cavity wall and composite resin under SEM study. In this study, class V cavities with cementum margin were prepared on the buccal surfaces of 15 extracted human premolar teeth and teeth were randomly assigned 3 groups of 5 teeth each. The cavities were filled with three dentin bonding agents and two composite resins were investigated for this study: three dentin bonding agents; Scotchbond 2, Scotchbond Multi-Purpose. All-Bond 2, two composite resins; Silux Pius, Z-100. Group 1 : Scotchbond 2 + Silux Plus Group 2 : Scotchbond Multi~Purpose + Z-100 Group 3 : All-Bond 2 + Z-100 The restored teeth were stored in 100% relative humidity at $37^{\circ}C$ for 7 days. And then, the roots of the teeth were removed with the tapered fissure bur and the remaining crowns were sectioned occlusogingivally through the center of restorations. Adaptation at tooth-restoration interface was assesed occlusally, gingivally, and axially by scanning electron microscope. The results were as follows : 1. In Group 1, the adaptation to dentinal wall of Scotchbond 2 was poor, but the adaptation to enamel wall of Scotchbond 2 was excellent. 2. In Group 2, the adaptation to occlusal was axial wall and gingival wall of Scotchbond Multi-Purpose was excellent. Especially in axially wall, the dentin bonding agents infiltrated into dentinal tubules and there was excellent adaptation to dentinal wall. 3. In Group 3, the adaptation to occlusal wall and axial wall of All-Bond 2 was excellent. But in gingival wall, there was gap formation between composite resin and dentin bonding agent.

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The Potential Energy Surface of BH5 and the Rate of the Hydrogen Scrambling

  • Kim, Kyung-Hyun;Kim, Yong-Ho
    • Bulletin of the Korean Chemical Society
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    • 제24권6호
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    • pp.763-770
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    • 2003
  • The $BH_5$ molecule, which is suggested as an intermediate of the acidolysis of $BH_4^-$, contains a weak two-electron-three-center bond and it requires extremely high-level of theories to calculate the energy and structure correctly. The structures and energies of $BH_5$ and the transition state for the hydrogen scrambling have been studied using recently developed multi-coefficient correlated quantum mechanical methods (MCCMs). The dissociation energies and the barrier heights agree very well with the previous results at the CCSD(T)/ TZ(3d1f1g, 2p1d) level. We have also calculated the potential energy curves for the dissociation of $BH_5$ to $BH_3$ and $H_2$. The lower levels of theory were unable to plot correct potential curves, whereas the MCCM methods give very good potential energy curves and requires much less computing resources than the CCSD(T)/ TZ(3d1f1g,2p1d) level. The potential energy of the $BH_5$ scrambling has been obtained by the multiconfiguration molecular mechanics algorithm (MCMM), and the rates are calculated using the variational transition state theory including multidimensional tunneling approximation. The rate constant at 300 K is 2.1 × $10^9s^{-1}$, and tunneling is very important.