Author Archive

Nanorods in minutes

PbSe nanorods have been successfully made by solution–liquid–solid (SLS) growth of PbSe nanocrystals. This growth was followed by oriented attachment of adjacent PbSe nanoparticles. The team from South Korea who carried out this synthesis used Bi catalysts dispersed in the precursor solution to make these nanocrystals thereby reducing the time and temperature taken to produce them.

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Enhanced formation of PbSe nanorods via combined solution–liquid–solid growth and oriented attachment
Min-Seok Kim and Yun-Mo Sung
CrystEngComm, 2012, DOI: 10.1039/C2CE06353K

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2012 GRC on Crystal Engineering

Christer Aakeroy, co-Vice Chair of the GRC

The 2012 GRC on Crystal Engineering is taking place this year from June 10-15, 2012 at Waterville Valley Resort, NH, USA. This GRC will be chaired by Robin Rogers, with co-Vice-Chairs Mike Zaworotko and CrystEngComm Associate Editor, Christer Aakeroy. The meeting will also include a new and exciting Gordon Research Seminar (GRS) in which only students and postdocs may present or lead discussions.  More information is available on the GRC website.

The 2012 GRC on Crystal Engineering follows the highly successful first ever GRC on Crystal Engineering (2010) which had over 160 international participants. Read about my experience at the excellent 2010 GRC in this editorial.

 

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Hot Article: Polar Crystals

‘To get a polar crystal is still a challenging task,’ say Roberto Centore and colleagues. However in their CrystEngComm Hot article they in fact tell us about the discovery of a new class of non-chiral compounds forming polar crystal structures.

Their compounds are made by condensation of 4-hydroxybenzohydrazide with a variety of non-chiral aliphatic ketones, both cyclic and acyclic, such as methyl-ethylketone, acetone, cyclohexanone and cyclobutanone and all of them exhibit second harmonic generation (SHG) activity. In one case, they found that solid state polymorphism characterized by single-crystal-to-single-crystal transitions between polar phases was taking place.

Read their paper now – free to access until the 4th February:

A series of compounds forming polar crystals and showing single-crystal-to-single-crystal transitions between polar phases
Roberto Centore, Mojca Jazbinsek, Angela Tuzi, Antonio Roviello, Amedeo Capobianco and Andrea Peluso
CrystEngComm, 2012, DOI: 10.1039/C2CE06352B

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100th Anniversary of crystal X-ray diffraction

As lots of you may already know this year is the 100th anniversary of Max Laue’s discovery of the diffraction of X-rays on crystals! German chemist Laue published a paper on his findings in 1912 and was awarded the Nobel Prize for Physics in 1914. According to his Nobel Lecture (as detailed on the Nobel Prize website), the discovery originated when he was discussing problems related to the passage of waves of light through a periodic, crystalline arrangement of particles. The idea then came to him that the much shorter electromagnetic rays, which X-rays were supposed to be, would cause in such a medium some kind of diffraction or interference phenomena and that a crystal would provide such a medium. More information about Laue and his intriguing story can be found on the Nobel website.

Of course crystallography has come a long way since then as we see in CrystEngComm every day. For example, many groups are now even looking at x-ray diffraction of crystals under pressure as featured in our recent themed issue.

I’m sure there are many events happening around the world to commemorate this discovery – one which has already come to my notice is at the 20th Annual Meeting of the German Crystallographic Society which will be held at the University of Munich, 12-15 March, 2012. In a dedicated ‘Laue Day’ they plan to analyze historical and future perspectives of diffraction methods.

If you are planning to hold an event to highlight the anniversary why not let us know by posting a comment on this blog post below……

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Polymorphs and proline: implications for polymorphic screening in Pharma

The particular form a crystalline drug takes is highly relevant in the pharma industry as different crystal forms often have different properties such as dissolution rates or stabilities. Though crystallisation processes are commonplace in the production of enantiopure drugs, the way in which one enantiomer can affect the crystallisation of another has not be thoroughly studied.

In their recent CrystEngComm Hot Article, Munson and Berendt carry out such a study investigating proline enantiomers in a range of enantiomeric ratios. They determine that both the enantiomeric ratio and crystallization method influenced the polymorphism of the racemic cocrystal. Read how their work will have implications for current polymorphic screening methods used in the pharma industry in their article:

Effect of enantiomeric ratio and preparation method on proline crystal form
Robert T. Berendt and Eric J. Munson
CrystEngComm, 2012, DOI: 10.1039/C2CE06445F

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Electrostatic potential in drug design

With bacterial resistance to established broad-spectrum antibiotics on the increase, detailed understanding of antibacterial action and drug resistance mechanisms are urgently needed. This understanding enables success in structure based drug design of novel bacterial topoisomerase inhibitors. In their CrystEngComm paper Birger Dittrich and co-workers discuss why molecular electrostatic potentials are key for rational drug design. They look at the optimization of structures on the basis of a comparison of nine fluoroquinolone antibiotics.

Electrostatic properties of nine fluoroquinolone antibiotics derived directly from their crystal structure refinements
Julian Jacob Holstein, Christian Bertram Hübschle and Birger Dittrich
CrystEngComm, 2012, DOI: 10.1039/C1CE05966A

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Call for papers: Ionic Liquids Themed Issue

We are pleased to announce an upcoming themed issue focussing on ionic liquids, with guest editors Mark Muldoon, Peter Nockemann and Cristina Lagunas-Castedo based at Queen’s University, Belfast. It is our pleasure to invite you to contribute to this themed issue.

The unique physical and chemical properties of ionic liquids as solvents and the potential to tune and control these properties by selecting the appropriate cations and anions, make ionic liquids remarkably versatile for many applications. Recent publications demonstrate their increasing impact on crystal engineering, on materials and nanoscale synthesis, as well as for crystallisation processes.

Contributions in both experimental and theoretical aspects are most welcome. Ideally, contributions should be within the scope of a) the use of ionic liquids as solvents for crystallisation processes; b) ionic liquids for the synthesis of nanocrystalline materials and porous materials; c) the use of ionic liquids for co-crystallisation or crystal structures of ionic liquid salts (including pharmaceutically relevant compounds and metal-containing ionic liquids); d) theoretical studies (for example understanding solid/liquid phase transitions).

How to submit?

All types of manuscript, Communications, Full Papers and Highlights will be considered for publication. We aim to publish this themed issue in late summer 2012 and therefore would like to receive manuscripts by 8th February 2012. The manuscript should be prepared according to the format for regular articles and should be submitted via our online system. All invited manuscripts will be subjected to the normal refereeing procedure.

Deadline for Submission: 8th February 2012

Please indicate on submission that your manuscript is intended for this themed issue and direct any questions to the CrystEngComm Editorial Office.

We invite you to also check out previous themed issues featuring in CrystEngComm. Read them here now.

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Hot Article: Calixarene crystals capture carbon dioxide

In their CrystEngComm Hot Article, Hirohito Tsue and colleagues from Kyoto University, demonstrate crystallographic evidence of trapped volatile gases in an azacalixarene structure. The paper looks at the solid–gas sorption behaviors of azacalixarenes at low temperatures among five gases, N2, O2, Ar, CO2, and CH4.

 Why not read Tsue’s study for free until 16th December……..

Crystallographic analysis of CO2 sorption state in seemingly nonporous molecular crystal of azacalix[4]arene tetramethyl ether exhibiting highly selective CO2 uptake
Hirohito Tsue, Hiroki Takahashi, Koichi Ishibashi, Rikako Inoue, Shun Shimizu, Daisuke Takahashi and Rui Tamura
CrystEngComm, 2012, DOI: 10.1039/C1CE06126G

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Copper sulfide nanotwins

In their recent CrystEngComm paper, Zhimao Yang and co-workers from Xi’an Jiaotong University in China, tell us about the cubic CuS cages they have synthesised. These cubic cages (see image below) form high-activity nanotwinned building blocks. The group also study the significance of these copper sulfide nanotwinned structures for enhancing the catalytic degradation of methylene blue (MB). Read more in the article below – free to access until the 2nd December.

Copper sulfide cages wholly exposed with nanotwinned building blocks
Shaodong Sun, Xiaoping Song, Chuncai Kong, Dongchu Deng and Zhimao Yang
CrystEngComm, 2012, DOI: 10.1039/C1CE06135F

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Hot Article: Polar polymorph with potential

In their recent CrystEngComm Hot Article, Xutang Tao and colleagues report the successful growth of bulk α-BaTe-Mo2O9 polar single crystals using a top-seeded solution growth method. The search for new polar materials is of current interest owing to their potentially important functional properties including piezoelectricity, pyroelectricity, ferroelectricity and secondharmonic generation activity.Indeed these large crystals offer a promising candidate for optical devices such as light modulators, colour filters, wave plates and
optical axis gratings.
Find out more about this polar polymorph by reading the article – free to access until 24 November 2011.

Bulk crystal growth and characterization of a new polar polymorph of BaTeMo2O9: α-BaTeMo2O9
Junjie Zhang, Zhonghan Zhang, Youxuan Sun, Chengqian Zhang and Xutang Tao
CrystEngComm, 2011, DOI: 10.1039/C1CE05922J

 

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