Author Archive

Register now for Behind the Paper, with the CCDC

Regular readers of CrystEngComm will know that in November 2020 we published a themed issue entitled The Cambridge Structural Database – A wealth of knowledge gained from a million structures. Guest edited by Suzanna Ward and Ghazala Sadiq, the issue celebrated the one millionth crystal structure, and featured 33 articles highlighting some of the many applications of the data in the CSD. 

 

Now, the community can find out more about the work behind some of these papers with a series of live webinars, jointly organised by the CCDC and CrystEngComm. Running throughout January 2021, these webinars will feature authors talking about the context, challenges and wider scope of their work.

 

Find out more and register here

 

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2020 CrystEngComm News

Well what a year this has been! CrystEngComm has published over 850 articles, from 57 countries with two themed issues and an increase on review content from 2019!

As we all know with 2020 came the emergence of Covid-19 all around the world. The virus has no doubt had an impact on all of our individual lives as well as to our research community in some form or other, and all of us here very much hope that you all continue to stay safe and well. If as a member of our community you do need support through Covid-19 there is further information available here.

We have all moved forward and adapted our lives and ways of working as best we can to enable us to positively continue what we do. Chair of the CrystEngComm Editorial Board Professor Pierangelo Metrangolo has this to say about how Covid-19 initially affected him and his research team and what he thinks the community has and can take from this experience:

 

The COVID-19 pandemic has affected everyone’s daily and professional lives for many months and perhaps there are more yet to come. I remember I was shocked during the first wave when we suddenly had to stop all of our activities. But within a few days, I realized that I had to react and started to serve my local community helping my department to produce hand-sanitizing liquid for hospitals, the Red Cross, police officers, and prisons in Lombardy. In the end we produced and distributed more than 100000 litres of the liquid. I remember the hours spent on the phone contacting business associates and acquaintances creating a network of manufacturers that could help supply the ingredients and distribute the product. Obviously, my research activity slowed down and it wasn’t easy to stay connected with the students and staff of my research group.

By the beginning of June, we resumed in-person research activities and started our “new normal” life finding ways to adapt and to connect online. There was little contact with other people, staying closed in the office, not much social or recreational activity, no trips and no conferences. On the other hand, I discovered that virtual platforms also offered new opportunities. For example, I started a series of virtual seminars at my department inviting colleagues from all over the world. Also, the 4th International Symposium on Halogen Bonding was held virtually in November and it was a great success. Although through a monitor, I realized how happy I was meeting with the familiar faces of friends and colleagues from the most remote places in the world, and seeing that they were in good health and we could discuss science while sipping a cup of coffee in the peace of our office or at home.

This pandemic will hopefully be over soon thanks to a vaccine. But we shall never forget the lessons learned in these difficult times. We as scientists have a great responsibility towards society, and chemistry, in particular, has fully demonstrated its role. The way we teach, carry out research and interact with colleagues perhaps will be impacted forever, but I really hope that we will keep the sense of solidarity, community, and global intent of preserving life and behave more responsibly for the benefit of humankind and our planet.”

 

Professor Pierangelo Metrangolo, Politecnico di Milano, Italy

CrystEngComm Editorial Board Chair

2020 also saw two new Associate Editors join the CrystEngComm Editorial Board, Professors Christian Doonan and Kwangyeol Lee. We were delighted to be able to welcome them to the team and are looking forward to working with them to continue to shape the future of the journal for the community. We also said goodbye to Professor Georg Garnweitner as an Associate Editor, and we thank him for his many years working so hard to help make the journal what it is today.

  Kwangyeol Lee is Professor of Chemistry at Korea University.  He graduated from Korea Advanced Institute of Science and Technology in 1992 and obtained his Ph.D. in Chemistry in 1997 from the University of Illinois at Urbana–Champaign under the supervision of Professor John. R. Shapley. Throughout his independent research career Professor Lee has studied nanocrystal growth, phase conversions in nanoscale as well as nanoparticle applications. His current research efforts are focused on the development of synthetic methodologies for nanoscale materials and the development of nanotechnologies to support the environment by creating sustainable energy. He is the recipient of the Distinguished Lectureship Award (2007, The Chemical Society of Japan), Wiley-KCS Young Scholar Award (2009, The Korean Chemical Society) and the Excellent Research Award (2019, Inorganic Chemistry Division of The Korean Chemical Society).

 

Christian Doonan is Professor of Chemistry at the University of Adelaide. He received his PhD at the University of Melbourne and carried out post-doctoral work with Professor Omar Yaghi at the University of California, Los Angeles. His research group focuses on the design and synthesis of Metal-organic Framework materials

for application to biotechnology and catalysis.

Christian is a member of the international MOF commission and his research has been recognised through several awards including, an Australian Research Council Future Fellowship, a distinguished lectureship award from the Chemical Society of Japan and a Double Hundred Talent Professorship at Qingdao University.

CrystEngComm commissioned themed issues in 2020

Two commissioned themed issues of the journal were published in 2020:

Crystal engineering for electrochemical applicationsthis issue focuses on crystal engineering strategies for the design of materials with superior properties for electrochemical applications, ranging from lithium-ion batteries and supercapacitors to electrocatalysts. It was guest edited by Professor Georg Garnweitner,TU Braunschweig and Professor Dongfeng Xue, Chinese Academy of Sciences.
The Cambridge Structural Database – A wealth of knowledge gained from a million structures – This issue combines 33 articles which highlight some of the many applications of the CSD in celebration of the one millionth crystal structure, a significant community achievement in 2019. Throughout this issue, the research carried out by the authors demonstrates the breadth of information and the variety of applications arising from the data in the CSD. Over the last half a century the complexity and size of structures have expanded, and the techniques and instrumentation used to determine new structures have evolved considerably. The articles show how far the field has evolved. It was guest edited by Suzanna C. Ward and Ghazala Sadiq, CCDC.

 

CrystEngComm Live Webinars in 2021

 

Join CCDC and CrystEngComm for 1 hour every Friday in January, where we’ll be going Behind the paper with an author who used insights from the 1 million structures in the CSD in a unique way.

Learn more and register here.

In these sessions you will get to know the author, hear their views on the wider context and challenges of their work – and have the chance to ask questions.

CrystEngComm Editor’s Collections, 2020

In late 2019 we started publishing Editor’s collections in CrystEngComm, and have continued this throughout 2020. Curated by Editorial Board members, these collections highlight a number of previously published articles from the journal which the Guest editor has personally chosen to showcase a specific area of research. The Editor’s collections published in 2020 are:

Editor’s Collection: Mechanochemistry, Guest editor Elena Boldyreva, Novosibirsk State University, Russia

Editor’s Collection: Computer aided solid form design, Guest Editor Susan Reutzel-Edens, Eli Lilly and Company, USA

Editor’s Collection: Zirconium based MOFs for catalysis, Guest Editor Professor Omar Farha, Northwestern University, USA

Editor’s collection: Metal Organic Frameworks as catalysts for water splitting and CO2 reduction, Guest Editor Tong-Bu Lu, Tianjin University of Technology, China

 

Accessing 2020 Content of Interest 

We have made it easier for readers to access recently published content of interest to them this year by curating subject collections, Highlight article collections and HOT article collections:

 

2020 Highlight Collection

HOT articles

Crystal Growth

Nanomaterials

Coordination networks

Crystal engineering techniques

Supramolecular & Polymorphism

Database Analysis

 

Publishing Open Access in CrystEngComm – Read & Publish

Open access (OA) is shaping the future of scholarly publishing, and we are doing all we can to build an open future that works for everyone. This includes developing services that will help you – whether you’re the one publishing, the one reading, or the one managing the entire process – to make important research more easily available.

 

Read & Publish is an alternative to the traditional subscription model. It helps both authors and institutions gradually tip the balance of their publishing output towards open access, making the process easier and more financially viable. With a Read & Publish agreement in place at their institution, authors can publish gold OA in all hybrid Royal Society of Chemistry journals, and readers have access to every paper in our journal portfolio.

More information on Read & Publish is available here.

 

We would love you to be part of the exciting future of CrystEngComm so on behalf of the Chair of the Editorial Board, Professor Pierangelo Metrangolo, Politecnico di Milano, Italy, we invite you to submit your research to CrystEngComm.

 

From all the CrystEngComm team, we thank you for your continued interest in and support of the journal and wish you a Happy New Year!

 

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The Cambridge Structural Database – A wealth of knowledge gained from a million structures, themed issue now online!

The latest CrystEngComm themed issue, The Cambridge Structural Database – A wealth of knowledge gained from a million structures is now online! Guest edited by Suzanna Ward, CCDC Head of Database, and Ghazala Sadiq, CCDC Senior Scientist, the issue highlights some of the many applications of the CSD in celebration of achieving one millionth crystal structure in 2019.

 

 

The collection features work by CrystEngComm Editorial Board Members Susan A. Bourne (University of Cape Town) and Aurora J. Cruz-Cabeza (University of Manchester) and covers a diverse range of topics, including MOF design, pharmaceutical manufacturing, and data mining.

 

Read the news article on this special issue at the CCDC website, or check out some Open Access articles from the collection below:

 

Enabling efficient exploration of metal–organic frameworks in the Cambridge Structural Database

 

CrystEngComm, 2020,22, 7152-7161

10.1039/D0CE00299B

A tutorial review for mining the ever growing number of metal–organic frameworks data in the Cambridge Structural Database, for MOF scientists of all backgrounds.

 

Can solvated intermediates inform us about nucleation pathways? The case of β-pABA

 

CrystEngComm, 2020,22, 7447-7459

10.1039/D0CE00970A

Using crystallography to search for nucleation pathways: α and β polymorphs of p-aminobenzoic acid.

 

 

From structure to crystallisation and pharmaceutical manufacturing: the CSD in CMAC workflows

CrystEngComm, 2020,22, 7475-7489

10.1039/D0CE00898B

Two workflows are presented that are relevant to the design and construction of end-to-end pharmaceutical manufacturing processes.

 

 

See the full collection here.

 

Submit your research or reviews on crystal engineering to CrystEngComm – see our author guidelines for information on our article types or find out more about the advantages of publishing in a Royal Society of Chemistry journal.

 

 

  

 

 

 

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Congratulations to Rahul Banerjee for winning the Shanti Swarup Bhatnagar Prize!

Rahul Banerjee, an Associate Editor of CrystEngComm, was recently awarded the Shanti Swarup Bhatnagar Prize for Science and Technology by the Council of Scientific & Industrial Research (CSIR) India. The award, named after the first director-general of the CSIR, is given annually to 8-10 researchers up to the age of 45 for notable and outstanding research in one of seven disciplines. Rahul, who is based at the Indian Institute of Science Education and Research (IISER), Kolkata, was awarded the prize in the field of Chemical Sciences for his work on structural chemistry with applications in hydrogen storage and carbon capture.

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Rahul recently guest edited a CrystEngComm themed issue on Covalent organic frameworks and organic cage structures, along with Neil R. Champness.

The whole team here at CrystEngComm would like to offer a huge congratulations to our colleague Rahul for this immense achievement!

 

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5th European Crystallographic School

This past July the 5th European Crystallographic School (ECS5) was held in Stellenbosch, South Africa. The event is aimed at providing young researchers with a comprehensive overview of all aspects of crystallography. An international selection of lectures covered a diverse range of topics ranging from fundamentals such as point groups and space groups to applications of the technique in biology and materials science. 

The school was a huge success, attracting over 60 participants from 10 countries across Europe and Africa. CrystEngComm was pleased to support the event by providing the participants with free subscriptions to the journal, as well as book vouchers which were awarded for active participation. The winners were Jacky Bouanga Boudiombo (University of Cape Town) and Siyabonga Hulushe (Rhodes University), with honourable mentions going to Aleix Tarrés Solé (CSIC), Stanley Manzini (Sasol Group Technology) and Marco Bardini (University of Cape Town).

Active participants, from left to right  – Aleix Tarrés Solé, Marco Bardini, Siyabonga Hulushe, Jacky Bouanga Boudiombo and Stanley Manzini

CrystEngComm offers sincere congratulations to the winners and would like to wish all participants the best in their future research.

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CrystEngComm at the 2nd Southeast Asian Conference on Crystal Engineering

This August the 2nd Southeast Asian Conference on Crystal Engineering (SEACCE-2) was held at Sunway University, Malaysia.

Hosted by Professor Edward R.T. Tiekink, Head the Research Centre for Crystalline Materials at Sunway, the event aims to bring together researchers from Southeast Asian Nations, along with China and India, to discuss recent advances from across the fields of crystallography, crystal engineering, supramolecular chemistry, and more! Over 100 delegates participated in the activities with good representation from Thailand, India, The People’s Republic of China, Singapore, Indonesia, Pakistan, Bangladesh and hosts Malaysia. Featuring internationally renowned keynote speakers Gautam Desiraju, Chen Xiao-Ming and Jagadese J. Vittal as well as submitted talks and poster presentations, the conference gave emerging investigators and students to network with some of the leaders in the field. 

 

CrystEngComm was pleased to support the event by offering awards for outstanding flash poster talks. The presenters were challenged to communicate and highlight the significance of their research effectively in three minutes using only a single static slide.

 

The winners of this challenging task were:

Cao Chenchen

Sun Yat-Sen University

(People’s Republic of China)

Linker Installation to Constructs a Bifunctional Metal-Organic Framework as Heterogeneous Catalyst for Stepwise Organic Transformations

Dr Suman Bhattacharya

University of Limerick

(Republic of Ireland)

Temperature-dependent Phase Switching in a 2D Layered MOF

Bibhuti Bhusan Rath

National University of Singapore

(Singapore)

Structural Transformation of Photoreactive Helical Coordination Polymers to Two Dimensional Structures

Dr Mark Lee Wun Fui

Universiti Kebangsaan Malaysia

(Malaysia)

Supramolecular Assembly of Rhenium(I) Complexes Mediated by Ligand Planarity via Interplay of Substituents

All prizes were presented by conference Chairman Edward Tiekink, the winners recieved a journal certificate and free subscription.

 

CrystEngComm and the RSC offer a hearty congratulations to all poster prize winners! 

 

 

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Congratulations to the JSCC Award Winners!

This July saw the occasion of The 68th Conference of Japan Society of Coordination Chemistry (JSCC), held in Sendai. The event was a great success, featuring over 200 talks in both English and Japanese spread over six sessions as well as almost 300 posters.

CrystEngComm‘s Deputy Editor, Mike Andrews, and the RSC’s Editorial Development Manager for Japan, Hiromitsu Urakami, were on-hand to award poster prizes for the best student poster presentations.

The CrystEngComm award went to Tomohiro Fujimoto of Osaka University, for his poster: 

オスミウム錯体を触媒とするアルケンの1,2-アミノアルコール化反応における反応活性種の同定と反応性

(Identification and Reactivity of Active Species in the 1,2-Aminohydroxylation of Alkenes Catalyzed by an Osmium Complex)

Tomohiro Fujimoto (right) receiving his award from Mike Andrews (left)

The Dalton Transactions Award went to Yuta Ohtsubo of Kyushu University, for his poster: 

多孔性金属錯体を利用した水素分子の核スピン変換の促進

(Promotion of nuclear spin conversion of molecular hydrogen using a porous metal complex)

Yuto Ohtsubo (right) receiving his award from Mike Andrews (centre) and Hiro Urakami (left)

 The Inorganic Chemistry Frontiers award went to Aoyama Tomokazu of Tokyo Metropolitan University for his poster:

水素生成を目指した新規水溶性超分子システムの調製と触媒機能

(Preparation and catalytic activity of a novel water-soluble supramolecular system aimed at hydrogen production)

Aoyama Tomokazu (right) receiving his award from Mike Andrews (centre) and Hiro Urakami (left)

The poster prize winners received a journal certificate and a colour changing RSC mug!

 

The RSC offers a hearty congratulations to prize winners at the JSCC!

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Congratulations to the CrystEngComm poster prize winner at ACA 2018!

This July saw the occasion of the 68th annual meeting of the American Crystallographers Association, held in Toronto. The event draws crystallographers and professionals in related fields from both academia and industry and features a packed schedule, including world-renowned keynote speakers. The CrystEngComm poster prize was awarded to Aristyo Soecipto, for his poster “Chiral Segregation of Space by Anionic Assemblies found in Tartramide-based Spiroborate Salts.

Aristyo works in the group of Professor Ian D. Williams at the Hong Kong University of Science and Technology. CrystEngComm would like offer a hearty congratulations to Aristyo for his excellent poster presentation!

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ISXB-3 and the IUPAC Workshop on Group 14-16 Interactions

This month saw the occasion of the 3rd International Symposium on Halogen Bonding, held in Greenville, South Carolina and chaired by Professor Bill Pennington (Clemson University). The event was a huge success, attracting over 90 participants from 21 countries, who came to discuss the latest developments in this exciting field of crystal engineering. Covering topics ranging from fundamentals like the refinement of the σ- and π-hole model to applications in fields such as pharmaceuticals, catalysis, and functional materials, the discussions were broad and vibrant – in part due to a strong showing of early career researchers. Three such promising academics presented in a special Rising Stars session, which CrystEngComm was pleased to support.  

Presenting in this session was (pictured, left-to-right) Rafael Nunes of the University of Lisbon, Professor Davita L. Watkins of the University of Mississippi, and Dr Filip Topic of McGill University, they each received discounted registration and a personal invitation to submit to CrystEngComm.

Immediately prior to the symposium was a satellite workshop on the IUPAC project to characterize chalcogen, pnictogen, and tetrel bonds – analogous interactions in which Group 14-16 element act as the electrophilic sites. Organized and Chaired by Professor Giuseppe Resnati (Politecnico Milano), the workshop featured a lively poster session and the RSC provided awards for two of the researchers presenting their work. The CrystEngComm prize went to Patrick Wonner of Ruhr-University-Bochum for his poster entitled “Carbon-halogen Bond Activation by Selenium-Based Chalcogen Bonding“, while the NJC prize went to Asia Marie Riel of Université de Rennes for her poster entitled “Isolated and Expanded Chalcogen Bond Halide Networks” (both pictured below).

Left-to-Right: Giuseppe Resnati (Chair of IUPAC Workshop), Khadijatul Kobra (winner of AICIng poster prize), Patrick M.J. Szell (winner of ACS poster prize), Asia Marie Riel (winner of RSC NJC poster prize), Patrick Wonner (winner of RSC CrystEngComm poster prize), Alex Elmi (winner of Springer poster prize), and Bill Pennington (Chair of ISXB-3). 

CrystEngComm offers a huge congratulations to all Rising Stars and poster prize winners!

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Crystalline Materials for Environmental Remediation Web Collection

The capability of the natural environment to absorb the waste products of human enterprise and industry is being put under great strain by the growth in the world’s population and economy. Environmental remediation – the decontamination of soil, air, and water – and waste stream treatment are of the highest priority.

From carbon dioxide capture by MOFs and other porous materials, to the photocatalytic degradation of organic pollutants by crystalline nanomaterials, our new post-publication collection showcases recent work that demonstrates how Crystal Engineering is being applied to solve one of humanity’s most pressing challenges.

Here are a selection of the articles and ‘Highlight’ reviews included in the collection:

 

Articles

 

A novel methoxy-decorated metal–organic framework exhibiting high acetylene and carbon dioxide storage capacities

 

CrystEngComm, 2017,19

1464-1469

10.1039/C6CE02291J

A new microporous metal–organic framework with optimized pore space and open metal sites has been realized, exhibiting high acetylene and carbon dioxide storage capacities.

Capture of volatile iodine by newly prepared and characterized non-porous [CuI]n-based coordination polymers

CrystEngComm, 2017,19, 6116-6126

10.1039/C7CE01193H

Four new non-porous copper(I) iodide coordination polymers have been synthesized and demonstrate volatile iodine capture with simultaneous fluorescence quenching.

 

 

Luminescent sensing and photocatalytic degradation properties of an uncommon (4,5,5)-connected 3D MOF based on 3,5-di(3′,5′-dicarboxylphenyl)benzoic acid

  

CrystEngComm, 2017,19, 4368-4377 

10.1039/C7CE01012E

An uncommon microporous MOF 1 used as fluorescent chemosensor for NACs and as photocatalyst.

 

 

 

Highlights

 

Metal–organic frameworks with Lewis acidity: synthesis, characterization, and catalytic applications

CrystEngComm, 2017,19, 4066-4081 

10.1039/C6CE02660E

In this highlight, we review the recent development in the design and synthesis of metal–organic frameworks with Lewis acidity, the characterization techniques of Lewis acid sites, and their applications in heterogeneous catalysis.

 

Hierarchically structured magnesium based oxides: synthesis strategies and applications in organic pollutant remediation

CrystEngComm, 2017,19, 6913-6926

10.1039/C7CE01755C

In this highlight, we review the design and formation of MgO based hierarchical structures and cover some selected examples on their applications in adsorption of organic contaminants.

 

Hollow CuxO (x = 2, 1) micro/nanostructures: synthesis, fundamental properties and applications

CrystEngComm, 2017,19, 6225-6251 

10.1039/C7CE01530E

In this review, we comprehensively summarize the important advances in hollow CuxO micro/nanostructures, including the universal synthesis strategies, the interfacial Cu–O atomic structures as well as the intrinsic properties, and potential applications. Remarks on emerging issues and promising research directions are also discussed.

 

 

See the full collection here.

 

Submit your research or reviews on crystal engineering of materials for environmental applications to CrystEngComm – see our author guidelines for information on our article types or find out more about the advantages of publishing in a Royal Society of Chemistry journal.

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