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XB_ChB

@XB_ChB

Feed that aggregates publications about Halogen and Chalcogen Bonding from over 200 journals of 15 editors. Contact @CYL_Lab for any question.

 Sherbrooke, Canada
cyl.recherche.usherbrooke.ca
Joined October 2024
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Supramolecular Polymers of Chiral and Achiral Rhodium and Iridium Complexes of N-Confused Porphyrin. doi.org/10.1021/acs.inorgche…
Supramolecular Polymers of Chiral and Achiral Rhodium and Iridium Complexes of N-Confused Porphyrin

Supramolecular Polymers of Chiral and Achiral Rhodium and Iridium Complexes of N-Confused Porphyrin

Abstract. A series of rhodium(III) and iridium(III) complexes of N-confused porphyrin (NCP) was synthesized and characterized by spectroscopic, electrochem

pubs.acs.org
58
POLEN: An OpenMM Framework for ML/MM Simulations with Mutually Polarizable AMOEBA Embedding. doi.org/10.26434/chemrxiv.15…

POLEN: An OpenMM Framework for ML/MM Simulations with Mutually Polarizable AMOEBA Embedding |...

Hybrid machine-learning and molecular mechanics formulations have been growing over the years. The attractive cost-effectiveness for big systems (such as protein complexes) has made these methods...

chemrxiv.org
59
Design, synthesis, and structural characterization of new benzofuoro[3,2-b]pyridinone derivatives with antimicrobial activity: Insights from molecular docking and ADME studies. doi.org/10.1016/j.molstruc.2…
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A Bioinspired Gold–Chalcogen Bonding Synergistic Catalysis Platform: Switchable Activation and Dynamic Functional Group Sampling. doi.org/10.1021/jacs.6c18562
A Bioinspired Gold–Chalcogen Bonding Synergistic Catalysis Platform: Switchable Activation and...

A Bioinspired Gold–Chalcogen Bonding Synergistic Catalysis Platform: Switchable Activation and...

Abstract. Enzymes achieve exceptional catalytic efficiency by leveraging proximity effects and cooperative interactions, inspiring the design of artificial

pubs.acs.org
83
Halogen bonding at halonium centers: Geometric anatomy from crystallographic big data mined by natural and artificial intelligence. doi.org/10.1016/j.ccr.2026.2…
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Carbazole-Based Catalysts as a Versatile Platform for Halogen-Bonding and Photoredox Catalysis. doi.org/10.1021/acs.joc.6c02…
Carbazole-Based Catalysts as a Versatile Platform for Halogen-Bonding and Photoredox Catalysis

Carbazole-Based Catalysts as a Versatile Platform for Halogen-Bonding and Photoredox Catalysis

AbstractThis report describes an electron-rich carbazole catalyst for the photogeneration of radicals from a range of alkyl halides. Mechanistic studies sh

pubs.acs.org
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214
Telluronium Coordination of Crown Ethers and Polyethers via Chalcogen Bonding: Coulombically Driven Strong Association, Highly Selective Coordination, and Templated Cyclization. doi.org/10.1021/acsorginorga…
Telluronium Coordination of Crown Ethers and Polyethers via Chalcogen Bonding: Coulombically Driven...

Telluronium Coordination of Crown Ethers and Polyethers via Chalcogen Bonding: Coulombically Driven...

Abstract. The ability of telluronium [Ar3Te]+ to bind crown ethers and acyclic polyethers through chalcogen bonding is investigated in the solid state and

pubs.acs.org
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297
Molecular Recognition by Halogen Bonding With Atomic Precision in a Covalent Organic Cage. doi.org/10.1002/anie.5640364
Molecular Recognition by Halogen Bonding With Atomic Precision in a Covalent Organic Cage

Molecular Recognition by Halogen Bonding With Atomic Precision in a Covalent Organic Cage

A covalent organic cage embedding a single inward-facing halogen-bond (XB) donor enables recognition of DMMP, a Sarin surrogate, with atomic precision through halogen bonding, while both the hydrog...

onlinelibrary.wiley.com
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132
Physical Origins of Anion Recognition in Rationally Designed Receptors: Balancing Interaction Energy and Drug Score. doi.org/10.1021/acs.jpca.6c0…
Physical Origins of Anion Recognition in Rationally Designed Receptors: Balancing Interaction...

Physical Origins of Anion Recognition in Rationally Designed Receptors: Balancing Interaction...

Abstract. The rational design of synthetic anion receptors requires a detailed understanding of how different noncovalent interactions govern molecular rec

pubs.acs.org
99
When Donors Cannot Choose, the Metal Decides: Acceptor-Site Hierarchy and Polyfurcated, Metal-Involving Halogen Bonds in Platinum(II) Cocrystals. doi.org/10.1021/acs.cgd.6c00…
When Donors Cannot Choose, the Metal Decides: Acceptor-Site Hierarchy and Polyfurcated, Metal-Inv...

When Donors Cannot Choose, the Metal Decides: Acceptor-Site Hierarchy and Polyfurcated, Metal-Inv...

Abstract. The square-planar complex [Pt(ppy){S2CN(CH2)6}] (1; ppyH = 2-phenylpyridine) presents, within a single molecule, a set of chemically distinct hal

pubs.acs.org
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206
A Complete 3 × 3 Metal × Halogen Isostructural Matrix: Opposing Ni/Pd/Pt and Cl/Br/I Trends in Hal···O(SO2) Halogen Bonds. doi.org/10.1021/acs.cgd.6c01…
A Complete 3 × 3 Metal × Halogen Isostructural Matrix: Opposing Ni/Pd/Pt and Cl/Br/I Trends in...

A Complete 3 × 3 Metal × Halogen Isostructural Matrix: Opposing Ni/Pd/Pt and Cl/Br/I Trends in...

Abstract. Isostructural exchange is a cornerstone of crystal engineering, yet systematic substitution has remained almost entirely one-dimensional; the sol

pubs.acs.org
87
Bismuth–Sulfur Engineered Zero‐Valent Iron Prioritizes Chloramphenicol‐Class Antibiotics Dechlorination Over Hydrogen Evolution and Nitro Reduction. doi.org/10.1002/anie.9298177
Bismuth–Sulfur Engineered Zero‐Valent Iron Prioritizes Chloramphenicol‐Class Antibiotics Dechlori...

Bismuth–Sulfur Engineered Zero‐Valent Iron Prioritizes Chloramphenicol‐Class Antibiotics Dechlori...

Bismuth–sulfur cointercalated zero-valent iron prioritizes chloramphenicol-class antibiotic dechlorination over H2 evolution and nitro reduction, lifting selectivity from 0.3%–2% to 39% and enabling...

onlinelibrary.wiley.com
118
Binding Four Iodine Atoms to a Single Pnictogen Atom in Halogen-Bonded Assemblies of Nitroprusside [Fe(CN)5NO]2− and C2I2. doi.org/10.1021/acs.cgd.6c01…
Binding Four Iodine Atoms to a Single Pnictogen Atom in Halogen-Bonded Assemblies of Nitroprusside...

Binding Four Iodine Atoms to a Single Pnictogen Atom in Halogen-Bonded Assemblies of Nitroprusside...

Abstract. The realization of high-order multifurcated halogen bonds (X-bonds) at a single atomic acceptor remains a major challenge in supramolecular chemi

pubs.acs.org
139
Bromine-Enabled Halogen-Bond-Promoted Electrochemical 16O/18O-Incorporation for Skeletal Editing of N -Heterocycles. doi.org/10.1021/acs.orglett.…
Bromine-Enabled Halogen-Bond-Promoted Electrochemical 16O/18O-Incorporation for Skeletal Editing of...

Bromine-Enabled Halogen-Bond-Promoted Electrochemical 16O/18O-Incorporation for Skeletal Editing of...

Abstract. Incorporating oxygen into N-heterocycles with simultaneous isotopic labeling remains challenging. Here, we report a metal-, oxidant-, and base-fr

pubs.acs.org
111
Photophysical, DFT Calculations, Electrochemical, and DNA-Binding Properties of 7-Chloroquinoline-Organochalcogen Hybrids. doi.org/10.1021/acsorginorga…
Photophysical, DFT Calculations, Electrochemical, and DNA-Binding Properties of 7-Chloroquinoline...

Photophysical, DFT Calculations, Electrochemical, and DNA-Binding Properties of 7-Chloroquinoline...

Abstract. Quinoline-based chromophores are of great interest in medicinal chemistry due to their ability to bind DNA, modulate key biochemical pathways, an

pubs.acs.org
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99
S–H···Te Hydrogen-Bonded Me 2 Te 2 –H 2 S Complex in an Argon Matrix: What Makes Heavy Chalcogens Prefer a Hydrogen Bond Over a Chalcogen Bond?. doi.org/10.1021/acs.jpclett.…
S–H···Te Hydrogen-Bonded Me2Te2–H2S Complex in an Argon Matrix: What Makes Heavy Chalcogens Prefer...

S–H···Te Hydrogen-Bonded Me2Te2–H2S Complex in an Argon Matrix: What Makes Heavy Chalcogens Prefer...

Abstract. The S–H···Te hydrogen-bonded Me2Te2–H2S complex was experimentally identified in a cold and solid argon matrix. Quantum chemical calculations pre

pubs.acs.org
88
Spontaneous Emergence of Homochiral Halogen-bonded Helices from Achiral Components. doi.org/10.26434/chemrxiv.15…

Spontaneous Emergence of Homochiral Halogen-bonded Helices from Achiral Components | ChemRxiv

Biological systems selectively use chiral molecules, such as L-amino acids and D-sugars, to construct single-handed helical structures including proteins, collagen, and DNA. Reproducing such handed...

chemrxiv.org
124
Supramolecular Halogen-Bonded Organic Frameworks (XOFs): From Structural Construction to Functional Applications. doi.org/10.1021/acsomega.6c0…
Supramolecular Halogen-Bonded Organic Frameworks (XOFs): From Structural Construction to Functional...

Supramolecular Halogen-Bonded Organic Frameworks (XOFs): From Structural Construction to Functional...

Abstract. Supramolecular halogen-bonded organic frameworks (XOFs) have emerged as a distinct class of crystalline material in which halogen bonding, rather

pubs.acs.org
74
Halogenated Nucleosides: Highly Toxic Biogenic Disinfection Byproducts Prevalent in Drinking Water. doi.org/10.1021/acs.est.6c07…
Halogenated Nucleosides: Highly Toxic Biogenic Disinfection Byproducts Prevalent in Drinking Water

Halogenated Nucleosides: Highly Toxic Biogenic Disinfection Byproducts Prevalent in Drinking Water

Abstract. Five decades of research on disinfection byproducts (DBPs) reveals only the tip of the iceberg, with humus as their primary precursor. Here, we i

pubs.acs.org
64
Enantiopure Telluronium Complexes through Bidentate Chalcogen Bonding: From Solid and in Solution Studies to Chiral Recognition. doi.org/10.26434/chemrxiv.15…

Enantiopure Telluronium Complexes through Bidentate Chalcogen Bonding: From Solid and in Solution...

This work demonstrates that tetravalent telluronium salts constitute versatile chalcogen bonding (ChB) receptors for polydentate phosphine oxide ligands. A range of bidentate phosphine oxides form...

chemrxiv.org
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