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Nicolò Tampellini

@ntampellini.bsky.social
24 followers 36 following 15 posts

PhD student (Miller group, Yale 🇺🇸) B. Sc. (Bencivenni & Righi group, UniBo 🇮🇹) Asymmetric catalysis with flasks and computers ⚗️💻 ntampellini.github.io

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Nicolò Tampellini @ntampellini.bsky.social · 07/10/2025
We often strive for a general asymmetric catalyst. But why is a catalyst general? How? Featurization and data analysis are great but don't give you any atomistic information. We wanted to find out, and about 6000 DFT free energies later, here we are. 🧵(1/7) pubs.acs.org/doi/10.1021/...
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Nature Reviews Chemistry @natrevchem.nature.com · 15/07/2025
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Chiral medium-sized rings beyond central chirality
Nature Reviews Chemistry, Published online: 14 July 2025; doi:10.1038/s41570-025-00735-1Chiral medium-sized rings (MSRs) beyond central chirality, with unique rigid–flexible features, show broad potential. This Review highlights progress in the enantioselective synthesis of axial, inherent and planar chiral MSRs, and it critically assesses key synthetic strategies.
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NaOH Bartfield @naohbartfield.bsky.social · 01/07/2025
Our approach to the total synthesis of chartelline C, out now in JACS. Photochemistry and unique topology gave way to some really interesting reactivity! pubs.acs.org/doi/10.1021/...
pubs.acs.org
Total Synthesis of Chartelline C
Chartellines are cytotoxic marine alkaloids that were isolated in the late 1980s. Their unique, heavily oxidized structures, comprising a spirocyclic β-lactam, a halogenated indolenine, a chloroenamide, and a 2-haloimidazole, have motivated extensive efforts toward their synthesis. However, only a single synthesis of any chartelline has been reported in the nearly 40 years since their isolation. Here, we describe a route to chartelline C (3) from the macrolactam 21, an intermediate we employed en route to the related securine and securamine alkaloids. The key challenges in converting macrolactam 21 to chartelline C (3) involve stereocontrolled construction of the C2–C3 enamide, isomerization of the trans-C10–C11 alkene, formation of the strained spirocyclic β-lactam, and chlorination of the enamide. Each of these challenges was addressed by an unconventional approach. The macrolactam 21 was converted to cis-enamide (2Z,10E)-24 by in situ masking of the C12 ketone, followed by stereoselective acid-catalyzed elimination of the C2 carbinolamide. The C10–C11 trans-alkene was isomerized by a photolytic process; control experiments suggest that this isomerization occurs by energy transfer. The β-lactam was constructed by a solid-state reaction involving the adsorption of the bromoindolenine 26 onto activated basic alumina. Late-stage enamide chlorination, which had been an obstacle in prior approaches, was accomplished by a novel photoredox-mediated halogenation. These latter studies suggest that N-haloanomeric amides and N-haloguanidines may act as halogen atom transfer agents under thermal or photolytic conditions. Finally, we show that chartelline C (3) reacts with sulfur-based nucleophiles, suggesting that further studies of their biological activity may be warranted.
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Marcel M @mrclmllr.bsky.social · 24/06/2025
After years of development and preparatory works which you might have seen on this profile, a major milestone is achieved: g-xTB marks not just an evolution, but a revolution in the capabilities of semiempirical quantum chemistry. Convince yourself! A thread. 🔗 chemrxiv.org/engage/chemr... #compchem
chemrxiv.org
g-xTB: A General-Purpose Extended Tight-Binding Electronic Structure Method For the Elements H to Lr (Z=1–103)
We present g-xTB, a next-generation semi-empirical electronic structure method derived from tight-binding (TB) approximations to Kohn–Sham density functional theory (KS-DFT). Designed to bridge the ga...
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Lipshultz Group @lipshultzsbu.bsky.social · 11/06/2025
Sharing our 1st preprint on our work on organo-Ti photocatalysis! We've found that titanocenes are photoactive catalysts for alcohol activation by LMCT excitation, enabling β-scission of alkoxyl radicals for degradative functionalization. Congrats Jagrut, Ashley & the whole team!
chemrxiv.org
Degradative Alcohol Functionalization by Titanocene Photocatalysis
Organotitanium complexes are scarcely employed in photocatalytic reactions despite their robust ligand-to-metal charge-transfer photo-chemistry. Herein, we describe the development of titanocene pho-t...
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Florian Mulks @ffmulks.bsky.social · 08/07/2024
Have you ever wondered if there is a better intuitive way of understanding ambident reactivity than HSAB or orbital vs. charge-control? Kindly refer to "Hard and Soft Electrons and Holes" that is in press at Chem by Cell Press. doi.org/10.1016/j.ch...
doi.org
Redirecting
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Kramer Group at DTU @kramergroup.bsky.social · 18/05/2025
We have an open PhD position! The project involves enantioselective C-H functionalization with transition-metal catalysis +/- photocatalysis. Please share with relevant candidates or apply here: efzu.fa.em2.oraclecloud.com/hcmUI/Candid... Deadline: July 6 Link to our recent work in comments.
efzu.fa.em2.oraclecloud.com
PhD scholarship in Organic Chemistry and Enantioselective Homogeneous Catalysis - DTU Chemistry
A fully-funded 3-year PhD position in organic chemistry, C-H functionalization, and homogeneous enantioselective metal catalysis under the supervision of Associate Professor Søren Kramer is available ...
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orca-qc-official.bsky.social @orca-qc-official.bsky.social · 28/04/2025
Dear ORCA community, it took a while, but now the ORCA 6.0 article is out! It serves as generic reference for ORCA 6.x. However, if you are serious about supporting our efforts, please take note of the suggested citations at the end of each ORCA run. wires.onlinelibrary.wiley.com/doi/10.1002/...
wires.onlinelibrary.wiley.com
Software Update: The ORCA Program System—Version 6.0
This article describes the philosophy behind- and new features in the ORCA quantum chemistry program suite, version 6.0.
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Prasad Jallepalli, MD, PhD @prasad.bsky.social · 04/04/2025
www.nytimes.com/2025/04/03/o... Really important piece to share widely. Too many Americans don’t know how severe a threat this Administration poses to our scientific infrastructure, global leadership, and health security
nytimes.com
Opinion | The Uncertain Fate of the Young American Scientist (Gift Article)
Young researchers are choosing between staying in science and staying in the United States.
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Nicolò Tampellini @ntampellini.bsky.social · 08/03/2025
Thanks to the Synthesis Workshop for having me! These folks are creating a wonderful, public set of chemistry content, check their work out :)
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Mark Levin @levinchem.bsky.social · 31/01/2025
If the federal funding situation continues to deteriorate, I would be willing to give talks wearing a NASCAR-style jacket saturated with sponsor's logos
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Nicolò Tampellini @ntampellini.bsky.social · 23/01/2025
It is finally out: my long-time obsession with "inherently" chiral medium-sized rings now has a catalytic, enantioselective method. After a number of disconnection attempts, we developed a strategy based on choosing the maximally preorganized disconnection, which [1/3] pubs.acs.org/doi/10.1021/...
A graphical table of content for the journal paper described in this post. 7- and 8-membered rings that feature unusual ring chirality are synthesized in an enantioenriched fashion under mild conditions by the action of the same iminophosphorane superbase catalyst.
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Giacomo Bartolucci (he) @gbart.bsky.social · 04/01/2025
1/n Some time ago my colleague, excellent cook, and friend Ivan told me: "Cacio e pepe is the recipe that I screw up more often. Let's make a project studying systematically the physics of that sauce". Prepare to get cheesy, I'm glad to share the Cacio e paper preprint: arxiv.org/abs/2501.00536
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Kjell Jorner @valencekjell.com · 29/11/2024
One week left to apply to this position in my group.
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