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Chemical Science HOT Articles: July 2021

New month, new HOT articles!

We are pleased to share a selection of our referee-recommended HOT articles for July 2021. We hope you enjoy reading these articles, congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

Browse a selection of our July HOT articles below:

Physically inspired deep learning of molecular excitations and photoemission spectra
Julia Westermayr and Reinhard J. Maurer
Chem. Sci., 2021, Advance Article

Synthesis and enantioseparation of chiral Au13 nanoclusters protected by bis-N-heterocyclic carbene ligands
Hong Yi, Kimberly M. Osten, Tetyana I. Levchenko, Alex J. Veinot, Yoshitaka Aramaki, Takashi Ooi, Masakazu Nambo and Cathleen M. Crudden
Chem. Sci., 2021, Advance Article

A copper-free and enzyme-free click chemistry-mediated single quantum dot nanosensor for accurate detection of microRNAs in cancer cells and tissues
Zi-yue Wang, Dong-ling Li, Xiaorui Tian and Chun-yang Zhang
Chem. Sci., 2021, Advance Article

Azanone (HNO): generation, stabilization and detection
Cecilia Mariel Gallego, Agostina Mazzeo, Paola Vargas, Sebastián Suárez, Juan Pellegrino and Fabio Doctorovich
Chem. Sci., 2021, Advance Article

Coumarin luciferins and mutant luciferases for robust multi-component bioluminescence imaging
Zi Yao, Donald R. Caldwell, Anna C. Love, Bethany Kolbaba-Kartchner, Jeremy H. Mills, Martin J. Schnermann and Jennifer A. Prescher
Chem. Sci., 2021, Advance Article

Conformational interplay in hybrid peptide–helical aromatic foldamer macrocycles
Sebastian Dengler, Pradeep K. Mandal, Lars Allmendinger, Céline Douat and Ivan Huc
Chem. Sci., 2021, Advance Article

Chemical Science, Royal Society of Chemistry

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Chemical Science HOT Articles: June 2021

New month, new HOT articles!

We are pleased to share a selection of our referee-recommended HOT articles for June 2021. We hope you enjoy reading these articles, congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

Browse a selection of our June HOT articles below:

[GaF(H2O)][IO3F]: a promising NLO material obtained by anisotropic polycation substitution
Qian-Ming Huang, Chun-Li Hu, Bing-Ping Yang, Zhi Fang, Yuan Lin, Jin Chen, Bing-Xuan Li and Jiang-Gao Mao
Chem. Sci., 2021, Advance Article

Photocleavable proteins that undergo fast and efficient dissociation
Xiaocen Lu, Yurong Wen, Shuce Zhang, Wei Zhang, Yilun Chen, Yi Shen, M. Joanne Lemieux and Robert E. Campbell
Chem. Sci., 2021, Advance Article

Electrochemically switchable polymerization from surface-anchored molecular catalysts
Miao Qi, Haochuan Zhang, Qi Dong, Jingyi Li, Rebecca A. Musgrave, Yanyan Zhao, Nicholas Dulock, Dunwei Wang and Jeffery A. Byers
Chem. Sci., 2021, Advance Article

Flow electrochemistry: a safe tool for fluorine chemistry
Bethan Winterson, Tim Rennigholtz and Thomas Wirth
Chem. Sci., 2021, Advance Article

Biomimetic enterobactin analogue mediates iron-uptake and cargo transport into E. coli and P. aeruginosa
Robert Zscherp, Janetta Coetzee, Johannes Vornweg, Jörg Grunenberg, Jennifer Herrmann, Rolf Müller and Philipp Klahn
Chem. Sci., 2021, Advance Article

Sensitization-initiated electron transfer via upconversion: mechanism and photocatalytic applications
Felix Glaser, Christoph Kerzig and Oliver S. Wenger
Chem. Sci., 2021, Advance Article
Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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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Reflecting on #RSCPoster 2021

RSCPoster

#RSCPoster is a global Twitter Poster Conference, held entirely online over the course of 24 hours. The event brings together the global chemistry community to network with colleagues across the world and at every career stage, share their research and engage in scientific debate.

The 2021 #RSCPoster Twitter Conference was held on 2 March, and brought together 5,500 attendees with almost 900 presenters from 62 countries sharing their science to a potential audience of over 41 million.

 

Yi-Tao Long, Chemcial ScienceChemical Science Associate Editor Yi-Tao Long was subject chair for #RSCAnalytical – we caught up with him to get his thoughts on the event and some advice for next year.

“This is the first time I joined this #RSCPoster event and found it really impressive. It is a very good opportunity for early career researchers and graduate students to present their work” noted Yi-Tao.

“As an Associate Editor, I think the presentation and storyline are so important for a scientific paper. Of course, science is the most important, but being interesting and appealing to a broad community is also vital” explains Yi-Tao. This advice holds true for #RSCPoster too. Yi-Tao advises, “be clear and readable when presenting the work, this makes it easier for others to be interested, especially researchers in other fields.”

This year’s #RSCAnalytical prize winner, @kellybrown_94, is a great example of this point, as Yi-Tao mentions, “this poster caught my eye at first glance”.

 

Check out the full list of winners – CLICK HERE

This year we also saw the introduction of #RSCPosterPitch – short videos from our poster presenters bringing their research to life in creative ways. The entries in this new category were impressive, check out the winning #RSCPosterPitch from @alanqf22 for inspiration!

https://twitter.com/alanqf22/status/1366721199858933770

 

And why not enter next year?

Look out for more information on the 2022 #RSCPoster Twitter Conference – coming soon!

  • no registration fees
  • participate from anywhere with Twitter access
  • meet researchers from all over the world, at every career stage
  • spend as little or as much time attending as you like
  • cash and community prizes for the best posters as judged by our excellent Committees
  • community prize for the best #RSCPosterPitch as selected by our General Committee

Thank you to all participants and judges and hope to see you next year!

With thanks to our sponsoring RSC Interest Groups & journals:

Separation Science GroupEnvironmental Chemistry Group | Molecular Spectroscopy Group | Porous Materials Group | Analyst | Analytical Methods | Biomaterials Science | Catalysis Science and Technology | ChemComm  | Chemical Science | Chemistry Education Research and Practice | Chem Soc Rev | CrystEngComm | Dalton Transactions | Energy & Environmental Science | Environmental Science: Atmospheres | Environmental Science: Nano | Environmental Science: Processes and Impacts | Environmental Science: Water Research & Technology | Faraday Discussions | Food & Function | Green Chemistry | JAAS | Journal of Materials Chemistry A | Journal of Materials Chemistry B | Journal of Materials Chemistry C | Lab on a Chip | Materials Advances | Materials Horizons | Molecular Omics | MSDE | Nanoscale | Nanoscale Advances | Nanoscale Horizons | Natural Product Reports | NJC | Organic & Biomolecular Chemistry | PCCP | Polymer Chemistry | Reaction Chemistry & Engineering | RSC Advances | RSC Chemical Biology | RSC Medicinal Chemistry |Soft Matter | Sustainable Energy & Fuels

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Chemical Science HOT Articles: May 2021

New month, new HOT articles!

We are pleased to share a selection of our referee-recommended HOT articles for May 2021. We hope you enjoy reading these articles, congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

Browse a selection of our May HOT articles below:

Aromatic side-chain flips orchestrate the conformational sampling of functional loops in human histone deacetylase 8
Vaibhav Kumar Shukla, Lucas Siemons, Francesco L. Gervasio and D. Flemming Hansen
Chem. Sci., 2021, Advance Article

Blue-conversion of organic dyes produces artifacts in multicolor fluorescence imaging
Do-Hyeon Kim, Yeonho Chang, Soyeon Park, Min Gyu Jeong, Yonghoon Kwon, Kai Zhou, Jungeun Noh, Yun-Kyu Choi, Triet Minh Hong, Young-Tae Chang and Sung Ho Ryu
Chem. Sci., 2021, Advance Article

Controllable DNA strand displacement by independent metal–ligand complexation
Liang-Liang Wang, Qiu-Long Zhang, Yang Wang, Yan Liu, Jiao Lin, Fan Xie and Liang Xu
Chem. Sci., 2021, Advance Article

Spatial-confinement induced electroreduction of CO and CO2 to diols on densely-arrayed Cu nanopyramids
Ling Chen, Cheng Tang, Kenneth Davey, Yao Zheng, Yan Jiao and Shi-Zhang Qiao
Chem. Sci., 2021, Advance Article

Manipulating valence and core electronic excitations of a transition-metal complex using UV/Vis and X-ray cavities
Bing Gu, Stefano M. Cavaletto, Daniel R. Nascimento, Munira Khalil, Niranjan Govind and Shaul Mukamel
Chem. Sci., 2021, Advance Article

Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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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Chemical Science welcomes new Associate Editor Graeme Day

We wish a very warm welcome to our new Chemical Science Associate Editor Graeme Day!

 

Chemcial Science Associate Editor Graeme Day

 

Graeme Day was born in Canada and studied chemistry, mathematics and computing science at Saint Mary’s University in Halifax before moving to the University of Oxford for a Masters in theoretical chemistry and a PhD in computational chemistry at University College London. After postdoctoral work in the Pfizer Institute for Pharmaceutical Materials at the University of Cambridge, Graeme began his independent research as a Royal Society University Research Fellow, also in Cambridge, spending most of his time working on modelling pharmaceutical materials and computational methods for interpreting terahertz spectra of molecular crystals. He moved to the University of Southampton in 2012, where he is now Professor of Chemical Modelling, and was awarded a European Research Council Starting Grant for the ‘Accelerated design and discovery of novel molecular materials via global lattice energy minimisation’ (ANGLE). This grant shifted the focus of his research to functional materials, including porous crystals and organic electronics.

In 2020, Graeme was awarded an ERC Synergy grant ‘Autonomous Discovery of Advanced Materials’ (ADAM) with Professors Andrew Cooper (Liverpool) and Kerstin Thurow (Rostock) to integrate computational predictions, chemical space exploration with automation and robotics in the materials discovery lab. He continues to work in the area of pharmaceutical solid form modelling, has worked on methods for NMR crystallography and has a developing interest in applying machine learning methods for accelerating simulations, analysing energy landscapes and generating ideas.

Browse a selection of Graeme’s work below:

Evolutionary chemical space exploration for functional materials: computational organic semiconductor discovery
Chi Y. Cheng, Josh E. Campbell and Graeme M. Day
Chem. Sci., 2020, 11, 4922-4933

Crystal structure determination of an elusive methanol solvate – hydrate of catechin using crystal structure prediction and NMR crystallography
Marta K. Dudek, Piotr Paluch, Justyna Śniechowska, Karol P. Nartowski, Graeme M. Day and Marek J. Potrzebowski
CrystEngComm, 2020, 22, 4969-4981

Photocatalytic proton reduction by a computationally identified, molecular hydrogen-bonded framework
Catherine M. Aitchison, Christopher M. Kane, David P. McMahon, Peter R. Spackman, Angeles Pulido, Xiaoyan Wang, Liam Wilbraham, Linjiang Chen, Rob Clowes, Martijn A. Zwijnenburg, Reiner Sebastian Sprick, Marc A. Little, Graeme M. Day and Andrew I. Cooper
J. Mater. Chem. A, 2020, 8, 7158-7170

Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights
Peng Cui, David P. McMahon, Peter R. Spackman, Ben M. Alston, Marc A. Little, Graeme M. Day and Andrew I. Cooper
Chem. Sci., 2019, 10, 9988-9997

 

Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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.

Keep up to date with our latest articles, reviews, collections & more by following us on Twitter. You can also keep informed by signing up to our E-Alerts.

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Chemical Science HOT Articles: April 2021

New month, new HOT articles!

We are pleased to share a selection of our referee-recommended HOT articles for April 2021. We hope you enjoy reading these articles, congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

 

Browse a selection of our April HOT articles below:

Reaction-based machine learning representations for predicting the enantioselectivity of organocatalysts
Simone Gallarati, Raimon Fabregat, Rubén Laplaza, Sinjini Bhattacharjee, Matthew D. Wodrich and Clemence Corminboeuf
Chem. Sci., 2021, Advance Article

Deaminative meta-C–H alkylation by ruthenium(ii) catalysis
Wen Wei, Hao Yu, Agnese Zangarelli and Lutz Ackermann
Chem. Sci., 2021, Advance Article

Prediction and mitigation of mutation threats to COVID-19 vaccines and antibody therapies
Jiahui Chen, Kaifu Gao, Rui Wang and Guo-Wei Wei
Chem. Sci., 2021, Advance Article

Recent advances in single atom catalysts for the electrochemical carbon dioxide reduction reaction
Jincheng Zhang, Weizheng Cai, Fang Xin Hu, Hongbin Yang and Bin Liu
Chem. Sci., 2021, Advance Article

Wavy graphene sheets from electrochemical sewing of corannulene
Carlo Bruno, Eleonora Ussano, Gianni Barucca, Davide Vanossi, Giovanni Valenti, Edward A. Jackson, Andrea Goldoni, Lucio Litti, Simona Fermani, Luca Pasquali, Moreno Meneghetti, Claudio Fontanesi, Lawrence T. Scott, Francesco Paolucci and Massimo Marcaccio
Chem. Sci., 2021, Advance Article

Oxidative additions of alkynyl/vinyl iodides to gold and gold-catalyzed vinylation reactions triggered by the MeDalphos ligand
Jessica Rodriguez, Alexis Tabey, Sonia Mallet-Ladeira and Didier Bourissou
Chem. Sci., 2021, Advance Article

 

Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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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Chemical Science welcomes new Associate Editor Hemamala Karunadasa

We wish a very warm welcome to our new Chemical Science Associate Editor Hemamala Karunadasa!

Hemamala Karunadasa Chemical Science Associate Editor

 

Hemamala Karunadasa is an Associate Professor of Chemistry at Stanford University and a Faculty Scientist at the SLAC National Lab. Her group is invested in gaining synthetic control over extended ionic solids, with a focus on halide perovskites. They seek to both improve technologically important materials as well as to design new materials with unprecedented properties.

Hemamala was born in Sri Lanka and attended school in Colombo. She studied solid-state chemistry at Princeton University, receiving her A.B. in 2003. She moved to molecular inorganic chemistry for my Ph.D., which she received from UC Berkeley in 2009, and for her postdoctoral studies at the Lawrence Berkeley National Lab and at the California Institute of Technology.

As an associate editor, Hemamala looks forward to receiving papers that provide fundamental insights into obtaining desirable properties from new materials.

 

Browse a selection of Hemamala’s work below:

Dimensional reduction of the small-bandgap double perovskite Cs2AgTlBr6
Bridget A. Connor, Raisa-Ioana Biega, Linn Leppert and Hemamala I. Karunadasa
Chem. Sci., 2020, 11, 7708-7715
DOI: 10.1039/D0SC01580F, Edge Article

A pencil-and-paper method for elucidating halide double perovskite band structures
Adam H. Slavney, Bridget A. Connor, Linn Leppert and Hemamala I. Karunadasa
Chem. Sci., 2019, 10, 11041-11053
DOI: 10.1039/C9SC03219C, Edge Article

Tuning the bandgap of Cs2AgBiBr6 through dilute tin alloying
Kurt P. Lindquist, Stephanie A. Mack, Adam H. Slavney, Linn Leppert, Aryeh Gold-Parker, Jonathan F. Stebbins, Alberto Salleo, Michael F. Toney, Jeffrey B. Neaton and Hemamala I. Karunadasa
Chem. Sci., 2019, 10, 10620-10628
DOI: 10.1039/C9SC02581B, Edge Article

Structural origins of broadband emission from layered Pb–Br hybrid perovskites
Matthew D. Smith, Adam Jaffe, Emma R. Dohner, Aaron M. Lindenberg and Hemamala I. Karunadasa
Chem. Sci., 2017, 8, 4497-4504
DOI: 10.1039/C7SC01590A, Edge Article

 

Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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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Chemical Science HOT Articles: March 2021

New month, new HOT articles!

We are pleased to share a selection of our referee-recommended HOT articles for March 2021. We hope you enjoy reading these articles, congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

 

Browse a selection of our March HOT articles below:

Photoactive electron donor–acceptor complex platform for Ni-mediated C(sp3)–C(sp2) bond formation
Lisa Marie Kammer, Shorouk O. Badir, Ren-Ming Hu and Gary A. Molander
Chem. Sci., 2021, Advance Article

Exploiting host–guest chemistry to manipulate magnetic interactions in metallosupramolecular M4L6 tetrahedral cages
Aaron J. Scott, Julia Vallejo, Arup Sarkar, Lucy Smythe, E. Regincós Martí, Gary S. Nichol, Wim T. Klooster, Simon J. Coles, Mark Murrie, Gopalan Rajaraman, Stergios Piligkos, Paul J. Lusby and Euan K. Brechin
Chem. Sci., 2021, Advance Article

DNA-based constitutional dynamic networks as functional modules for logic gates and computing circuit operations
Zhixin Zhou, Jianbang Wang, R. D. Levine, Francoise Remacle and Itamar Willner
Chem. Sci., 2021, Advance Article

Asymmetric synthesis of dihydro-1,3-dioxepines by Rh(ii)/Sm(iii) relay catalytic three-component tandem [4 + 3]-cycloaddition
Chaoran Xu, Jianglin Qiao, Shunxi Dong, Yuqiao Zhou, Xiaohua Liu and Xiaoming Feng
Chem. Sci., 2021, Advance Article

Targeted 1,3-dipolar cycloaddition with acrolein for cancer prodrug activation
Ambara R. Pradipta, Peni Ahmadi, Kazuki Terashima, Kyohei Muguruma, Motoko Fujii, Tomoya Ichino, Satoshi Maeda and Katsunori Tanaka
Chem. Sci., 2021, Advance Article

Three-membered cyclic digermylenes stabilised by an N-heterocyclic carbene
Zhaowen Dong, Jan Mathis Winkler, Marc Schmidtmann and Thomas Müller
Chem. Sci., 2021, Advance Article

 

Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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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Chemical Science HOT Articles: February 2021

New month, new HOT articles!

We are pleased to share a selection of our referee-recommended HOT articles for February 2021. We hope you enjoy reading these articles, congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

 

Browse a selection of our February HOT articles below:

Towards the rational design of ylide-substituted phosphines for gold(i)-catalysis: from inactive to ppm-level catalysis
Jens Handelmann, Chatla Naga Babu, Henning Steinert, Christopher Schwarz, Thorsten Scherpf, Alexander Kroll and Viktoria H. Gessner;
Chem. Sci., 2021, Advance Article

Ruthenium-catalyzed formal sp3 C–H activation of allylsilanes/esters with olefins: efficient access to functionalized 1,3-dienes
Dattatraya H. Dethe, Nagabhushana C. Beeralingappa, Saikat Das and Appasaheb K. Nirpal
Chem. Sci., 2021, Advance Article

Symmetry-related residues as promising hotspots for the evolution of de novo oligomeric enzymes
Jaeseung Yu, Jinsol Yang, Chaok Seok and Woon Ju Song
Chem. Sci., 2021, Advance Article

Desymmetrised pentaporphyrinic gears mounted on metallo-organic anchors
Seifallah Abid, Yohan Gisbert, Mitsuru Kojima, Nathalie Saffon-Merceron, Jérôme Cuny, Claire Kammerer and Gwénaël Rapenne
Chem. Sci., 2021, Advance Article

The atomic-level regulation of single-atom site catalysts for the electrochemical CO2 reduction reaction
Qingyun Qu, Shufang Ji, Yuanjun Chen, Dingsheng Wang and Yadong Li
Chem. Sci., 2021, Advance Article

Chemical tuning of spin clock transitions in molecular monomers based on nuclear spin-free Ni(ii)
Marcos Rubín-Osanz, François Lambert, Feng Shao, Eric Rivière, Régis Guillot, Nicolas Suaud, Nathalie Guihéry, David Zueco, Anne-Laure Barra, Talal Mallah and Fernando Luis
Chem. Sci., 2021, Advance Article
Chemical Science, Royal Society of Chemistry

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Chemical Science HOT Articles: January 2021

New year, new HOT article collection!

We are pleased to share a selection of our referee-recommended HOT articles for January 2021. We hope you enjoy reading these articles and congratulations to all the authors whose articles are featured! As always, Chemical Science is free to read & download.

You can explore our full 2021 Chemical Science HOT Article Collection here!

 

Browse a selection of our January HOT articles below:

Directed evolution of cyclic peptides for inhibition of autophagy
Joshua P. Gray, Md. Nasir Uddin, Rajan Chaudhari, Margie N. Sutton, Hailing Yang, Philip Rask, Hannah Locke, Brian J. Engel, Nefeli Batistatou, Jing Wang, Brian J. Grindel, Pratip Bhattacharya, Seth T. Gammon, Shuxing Zhang, David Piwnica-Worms, Joshua A. Kritzer, Zhen Lu, Robert C. Bast, Jr. and Steven W. Millward
Chem. Sci., 2021, Advance Article

Conformational analysis by UV spectroscopy: the decisive contribution of environment-induced electronic Stark effects
Jeremy Donon, Sana Habka, Michel Mons, Valérie Brenner and Eric Gloaguen
Chem. Sci., 2021, Advance Article

Identifying key mononuclear Fe species for low-temperature methane oxidation
Tao Yu, Zhi Li, Wilm Jones, Yuanshuai Liu, Qian He, Weiyu Song, Pengfei Du, Bing Yang, Hongyu An, Daniela M. Farmer, Chengwu Qiu, Aiqin Wang, Bert M. Weckhuysen, Andrew M. Beale and Wenhao Luo
Chem. Sci., 2021, Advance Article

A feasible approach for automatically differentiable unitary coupled-cluster on quantum computers
Jakob S. Kottmann, Abhinav Anand and Alán Aspuru-Guzik
Chem. Sci., 2021, Advance Article

A photoswitchable strapped calix[4]pyrrole receptor: highly effective chloride binding and release
David Villarón, Maxime A. Siegler and Sander J. Wezenberg
Chem. Sci., 2021, Advance Article

Controlling multiple orderings in metal thiocyanate molecular perovskites Ax{Ni[Bi(SCN)6]}
Jie Yie Lee, Sanliang Ling, Stephen P. Argent, Mark S. Senn, Laura Cañadillas-Delgado and Matthew J. Cliffe
Chem. Sci., 2021, Advance Article

Structural elucidation of a methylenation reagent of esters: synthesis and reactivity of a dinuclear titanium(iii) methylene complex
Takashi Kurogi, Kaito Kuroki, Shunsuke Moritani and Kazuhiko Takai
Chem. Sci., 2021, Advance Article
Chemical Science, Royal Society of Chemistry

Submit to Chemical Science today! Check out 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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