نتایج جستجو برای: halogen π

تعداد نتایج: 37828  

پایان نامه :وزارت علوم، تحقیقات و فناوری - دانشگاه سیستان و بلوچستان - دانشکده علوم پایه 1393

بر اساس نظریه پیوند هیدروژنی یاری شده توسط رزوناس (rahb)، پیوند هیدروژنی درون مولکولی (imhb) و عدم استقرار الکترونی π به میزان زیادی به یکدیگر وابسته اند. به علت تنوع زیاد سیستم های rahb، اعتبار سنجی نظریه rahb یکی از مشکلات اصلی در علوم فیزیکی است. در این پروژه ارتباط بین عدم استقرارالکترونی π و پیوند هیدروژنی درون مولکولی مورد بررسی قرار گرفته است. در همین راستا سه سیستم قابل قبول دو حلقه ای ...

2005
Semin Ozge Keskin Serpil Sahin Hamit Koksel

The effects of halogen lamp–microwave combination baking on the quality of cookies in terms of texture, color and spread ratio were studied. In addition, gelatinization and pasting properties of cookies baked in different ovens were assessed by using a Rapid Visco Analyzer. The hardness values of the cookies increased with increasing baking time and/or halogen power. The microwave power also co...

1998
Erik Page Michael Siminovitch

Extensive development of designs and prototyping of energy efficient torchiere systems using compact fluorescent lamps (CFLs) has lead directly to the production of CFL torchieres by a major US manufacturer. This paper compares the electrical and photometric characteristics of one of the new CFL torchieres to standard tungsten halogen torchieres (halogen uplighters). Power assessments and gonio...

Journal: :The journal of physical chemistry. A 2009
Margarita I Bernal-Uruchurtu Ramón Hernández-Lamoneda Kenneth C Janda

Halogen bonds have received a great deal of attention in recent years. Their properties, sometimes paralleled with those of hydrogen bonds, have not yet been fully understood. In this work, we investigate the nature of the intermolecular interactions between Cl(2) and Br(2) with water. Our analysis of several features of MP2/aug-cc-pVDZ-optimized stable clusters with different number and arrang...

Journal: :Organic & biomolecular chemistry 2016
Josué M Silla Matheus P Freitas

Halogen bonds are defined as interactions between halogens and a Lewis base in which the halogen (X) acts as the electrophilic species, and is typically explained by the presence of a σ-hole at the end of the C-X bond. Despite the important role of the halogen bond in intermolecularly interacting species, e.g. in acid-base reactions, enzyme inhibition and the supramolecular architecture, this i...

Journal: :Acta Crystallographica Section A Foundations of Crystallography 2006

Stability of the π-π stacking interactions in the Ben||substituted-coronene and HFBen||substituted-coronene complexes was studied using the computational quantum chemistry methods (where Ben and HFBen are benzene and hexaflourobenzene, || denotes π-π stacking interaction, substituted-coronene is coronene molecule which substituted with four X groups, and X= NH2, CH3, OH, H, F, CF3, CN and NO). ...

Journal: :Journal of computational chemistry 2016
Simon W. L. Hogan Tanja Van Mourik

The competition between hydrogen- and halogen-bonding interactions in complexes of 5-halogenated 1-methyluracil (XmU; X = F, Cl, Br, I, or At) with one or two water molecules in the binding region between C5-X and C4=O4 is investigated with M06-2X/6-31+G(d). In the singly-hydrated systems, the water molecule forms a hydrogen bond with C4=O4 for all halogens, whereas structures with a halogen bo...

Journal: :Acta crystallographica. Section C, Structural chemistry 2017
Patrick M J Szell Shaina A Gabriel Russell D D Gill Shirley Y H Wan Bulat Gabidullin David L Bryce

Halogen bonding is a noncovalent interaction between the electrophilic region of a halogen (σ-hole) and an electron donor. We report a crystallographic and structural analysis of halogen-bonded compounds by applying a combined X-ray diffraction (XRD) and solid-state nuclear magnetic resonance (SSNMR) approach. Single-crystal XRD was first used to characterize the halogen-bonded cocrystals forme...

Ahmad Khaled

In the combination of 5-fluorophenyl-1, 3, 7, 9-tetra methylpyrido [2, 3, d, d, 5, 6 dipyrimidine -2, 4, 6, and 8 tetron, there are 4 rings, respectively, ring that is attached to the halogen ring A and, respectively, a ring The lower and the right to the left of the ring A are called C, B, and D. Calculations and studies show that the amount of aromatics in halogen-ring A in all cases has the ...

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