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Wavefunction inc spartan'04 software for windows version 1.0.3
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Article Title: Synthesis and properties of novel poly(tetramethylsilnaphthylenesiloxane) derivatives
Article Snippet: Novel poly(tetramethylsilnaphthylenesiloxane) derivatives were synthesized and characterized by differential scanning calorimetry (DSC), thermogravimetry (TG), and X-ray diffraction analyses.. Poly(tetramethylsilnaphthylenesiloxane) derivatives were obtained by condensation polymerization of the corresponding disilanol derivatives, i.e. 1,4-, 1,5-, 2,6-, and 2,7-bis(dimethylhydroxysilyl)naphthalenes, which were prepared by the Grignard reaction using chlorodimethylsilane and the corresponding dibromonaphthalene derivatives followed by the hydrolyses, catalyzed by palladium on charcoal.. The obtained poly(tetramethyl-1,5-silnaphthylenesiloxane) was insoluble in common organic solvents; however, the other polymers exhibited the good solubility in common organic solvents, such as tetrahydrofuran (THF), chloroform, dichloromethane, and toluene.

Article Title: Selective recognition of <mml:math altimg="si1.gif" overflow="scroll" xmlns:xocs="http://www.elsevier.com/xml/xocs/dtd" xmlns:xs="http://www.w3.org/2001/XMLSchema" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns="http://www.elsevier.com/xml/ja/dtd" xmlns:ja="http://www.elsevier.com/xml/ja/dtd" xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:tb="http://www.elsevier.com/xml/common/table/dtd" xmlns:sb="http://www.elsevier.com/xml/common/struct-bib/dtd" xmlns:ce="http://www.elsevier.com/xml/common/dtd" xmlns:xlink="http://www.w3.org/1999/xlink" xmlns:cals="http://www.elsevier.com/xml/common/cals/dtd"><mml:mrow><mml:mmultiscripts><mml:mrow><mml:msub><mml:mrow><mml:mtext>H</mml:mt
Article Snippet: 0040-4039/$ see front matter 2012 Elsevier Ltd. A http://dx.doi.org/10.1016/j.tetlet.2012.03.047 ⇑ Corresponding author.. Tel.. : +82 53 9505588; fax: E-mail address: kimhs@knu.ac.kr (H.-S. Kim).

Article Title: Phenyl-naphthyl amine effect of new phenothiazine derivatives with high T(g) for hole injection and hole transporting materials.
Article Snippet: We synthesized a new HIL and HTL materials by using phenothiazinly moiety, 1,4-diphenothiazylbenzene [DPtzB], 3 ′ ,7 ′ ,3 ′′ ,7 ′′ -tetrakis(N-phenyl-2-naphthylamine)-1,4-diphenothiazyl-benzene [PNADPtzB].. Synthesized materials exhibited high Tg in the range of 175–202 C. These values are much better than commonly used hole transporting materials (2-TNATA and NPB).. The OLED device that used DPtzB as a HIL showed the highest efficiency of 4.31 cd/A at 10 mA/cm2.

Article Title: Correlating NH3-TPD and 1H MAS NMR measurements of zeolite acidity: proposal of an acidity scale
Article Snippet: The acidities (number and strength of the Brønsted acidic sites) of two zeolite samples, H-MFI and H-BEA, were measured by ammonia temperature-programmed desorption (ATPD) and proton nuclear magnetic resonance (H MAS NMR).. Deconvolutions of the ATPD and H MAS NMR spectra lead to acid sites distributions (number and strength) that are nearly similar.. Acid sites of increasing acid strength are characterized by higher desorption temperatures and higher H NMR chemical shifts.

Article Title: Electrophilic Aromatic Functionalization of Phenolic Photoresist Polymers
Article Snippet: Functionalization of both linear poly(4-hydroxystyrene) (PHS) and branched poly(4hydroxystyrene) (PHS-B) was accomplished via a Reimer-Tiemann electrophilic aromatic substitution reaction.. Linear and branched poly(4-hydroxystyrene-co-5vinylsalicylaldehyde) (pHS/5VSA and pHS-B/5VSA) copolymers were observed to undergo acid-catalyzed, novolac type self-crosslinking.. Both the pHS/5VSA and pHS-B/5VSA copolymer systems possessed a lower deep ultra violet microlithographic sensitivity compared to linear PHS when formulated in negative photoresists.

Article Title: Synthesis, electronic properties, and electrochemiluminescence of donor-substituted phenylethynylanthronitriles.
Article Snippet: A new series of π-conjugated donor-acceptor compounds (1-6) with inherent redox centers have been prepared and studied with respect to their electronic properties.. The photophysical characteristics of these compounds have been studied in relation to their structures.. Cyclic voltammetry and UV-vis spectroelectrochemistry were used to probe the ground-state electronic properties of the neutral and charged species.

Article Title: Model carbyne vs ideal and DNA catenanes.
Article Snippet: The structure and stability of two-component carbyne catenanes, viewed as model compounds for DNA catenanes, have been estimated by molecular mechanics (MM) calculations.. The carbyne catenane molecules studied were composed from interwined cyclic molecules constituted solely from carbon atoms bonded by alternating single and triple bonds.. The total number of carbon atoms in molecules studied was set to 60, and the complementary sizes of the catenane components varied.



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