Dominik P. Halter
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View article: Generative Deep Learning Pipeline Yields Potent Gram-Negative Antibiotics
Generative Deep Learning Pipeline Yields Potent Gram-Negative Antibiotics Open
The escalating crisis of multiresistant bacteria demands the rapid discovery of novel antibiotics that transcend the limitations imposed by the biased chemical space of current libraries. To address this challenge, we introduce an innovati…
View article: Generative deep learning pipeline yields potent Gram-negative antibiotics
Generative deep learning pipeline yields potent Gram-negative antibiotics Open
The escalating crisis of multiresistant bacteria demands the rapid discovery of novel antibiotics that transcend the limitations imposed by the biased chemical space of current libraries. To address this challenge, we introduce an innovati…
View article: Endohedral Coordination of Bulky Substrates in Metalloenzyme‐Like Organometallic Nanotubes
Endohedral Coordination of Bulky Substrates in Metalloenzyme‐Like Organometallic Nanotubes Open
Artificial receptors inspired by metalloenzymes share three key properties: a structurally flexible cavity, substrate binding via metal‐ligand coordination, and metal‐based redox activity. Herein, we report an organometallic nanotube with …
View article: Hydrogen Storage in Flexible Frameworks
Hydrogen Storage in Flexible Frameworks Open
Hydrogen may be useful as carbon-free fuel source, but before hydrogen can be economically adopted at large scales, improved materials for storage are needed. Here we use a combination of high-pressure isothermal hydrogen adsorption measur…
View article: Endohedral Coordination of Bulky Substrates in Metalloenzyme-like Organometallic Nanotubes
Endohedral Coordination of Bulky Substrates in Metalloenzyme-like Organometallic Nanotubes Open
Artificial receptors inspired by metalloenzymes share three key properties: a structurally flexible cavity, substrate binding via metal–ligand coordination, and metal-based redox activity. Herein, we report an organometallic nanotube with …
View article: Monomeric M(<scp>ii</scp>) (M = Fe, Co, Ni) complexes supported by bulky aryloxide ligands tethered to an arene functionality; synthesis, electrochemistry and study of the M(<scp>ii</scp>)–arene interaction
Monomeric M(<span>ii</span>) (M = Fe, Co, Ni) complexes supported by bulky aryloxide ligands tethered to an arene functionality; synthesis, electrochemistry and study of the M(<span>ii</span>)–arene interaction Open
Strength of M–arene interaction (2-Ni) ≫ (2-Co) > (2-Fe), IR spectroscopy to probe M–arene interaction, THF coordination completely disturbs M–arene interaction.
View article: <i>Ex Situ</i> Electro‐Organic Synthesis – A Method for Unrestricted Reaction Control and New Options for Paired Electrolysis
<i>Ex Situ</i> Electro‐Organic Synthesis – A Method for Unrestricted Reaction Control and New Options for Paired Electrolysis Open
Classic in situ electro‐organic synthesis with substrates in an electrolyzer must compromise process conditions to balance electro‐ and thermochemical steps at both electrodes. This often restricts efficiency and product selectivity, since…
View article: Ex situ electro-organic synthesis – A method for unrestricted reaction control and new options for paired electrolysis
Ex situ electro-organic synthesis – A method for unrestricted reaction control and new options for paired electrolysis Open
Classic in situ electro-organic synthesis with substrates in an electrolyzer must compromise process conditions to balance electro- and thermochemical steps at both electrodes. This often restricts efficiency and product selectivity, since…
View article: Electrocatalytic Transfer Hydrogenation of 1‐Octene with [( <sup>tBu</sup> PCP)Ir(H)(Cl)] and Water
Electrocatalytic Transfer Hydrogenation of 1‐Octene with [( <sup>tBu</sup> PCP)Ir(H)(Cl)] and Water Open
Electrocatalytic hydrogenation of 1‐octene as non‐activated model substrate with neutral water as H‐donor is reported, using [( t Bu PCP)Ir(H)(Cl)] ( 1 ) as the catalyst, to form octane with high faradaic efficiency (FE) of 96 % and a k ob…
View article: Construction and Evaluation of Cheap and Robust Miniature Ag/AgCl Reference Electrodes for Aqueous and Organic Electrolytes
Construction and Evaluation of Cheap and Robust Miniature Ag/AgCl Reference Electrodes for Aqueous and Organic Electrolytes Open
Stable reference electrodes (REs) are crucial for reliable voltammetry, controlled potential electrosynthesis, or spectro‐electrochemistry. Yet, inferior pseudo‐REs, such as plain Ag wire are often used, because commercial REs are expensiv…
View article: CCDC 2249204: Experimental Crystal Structure Determination
CCDC 2249204: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2249205: Experimental Crystal Structure Determination
CCDC 2249205: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2249203: Experimental Crystal Structure Determination
CCDC 2249203: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: Electrocatalytic Transfer Hydrogenation of 1-Octene with [(tBuPCP)Ir(H)(Cl)] and Water
Electrocatalytic Transfer Hydrogenation of 1-Octene with [(tBuPCP)Ir(H)(Cl)] and Water Open
Electrocatalytic hydrogenation of 1-octene as nonactivated model substrate with neutral water as H-donor is reported, using [(tBuPCP)Ir(H)(Cl)] (1) as the catalyst, to form octane with high faradaic efficiency (FE) of 96% and a kobs of 87 …
View article: CCDC 2266859: Experimental Crystal Structure Determination
CCDC 2266859: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2265895: Experimental Crystal Structure Determination
CCDC 2265895: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 2265893: Experimental Crystal Structure Determination
CCDC 2265893: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: Beyond Metal-Arenes: Monocarbonyl Ruthenium(II) Catalysts for Transfer Hydrogenation Reactions in Cancer Cells
Beyond Metal-Arenes: Monocarbonyl Ruthenium(II) Catalysts for Transfer Hydrogenation Reactions in Cancer Cells Open
With the aim to design new water-soluble organometallic Ru(II) complexes acting as anticancer agents catalysing transfer hydrogenation (TH) reactions with biomolecules, we have synthesized four Ru(II) monocarbonyl complexes (1-4) featuring…
View article: Proton Independent Electrocatalytic Transfer Hydrogenation of Styrene with [(tBuPCP)Ir(H)(Cl)] and Water
Proton Independent Electrocatalytic Transfer Hydrogenation of Styrene with [(tBuPCP)Ir(H)(Cl)] and Water Open
A new pathway of electrocatalytic transfer hydrogenation with neutral water as the H-donor was discovered using [(tBuPCP)Ir(H)(Cl)] (1) as the catalyst and styrene as a model substrate in THF electrolyte. Cyclic voltammetry experiments wit…
View article: CCDC 1996337: Experimental Crystal Structure Determination
CCDC 1996337: Experimental Crystal Structure Determination Open
View article: Self-Adjusting Binding Pockets Enhance H₂ and CH₄ Adsorption in a Uranium-Based Metal–Organic Framework
Self-Adjusting Binding Pockets Enhance H₂ and CH₄ Adsorption in a Uranium-Based Metal–Organic Framework Open
A new, air-stable, permanently porous uranium(IV) metal–organic framework U(bdc)2 (1, bdc2− = 1,4-benzenedicarboxylate) was synthesized and its H2 and CH4 adsorption properties were invest…
View article: Self-Adjusting Binding Pockets Enhance H₂ and CH₄ Adsorption in a Uranium-Based Metal–Organic Framework
Self-Adjusting Binding Pockets Enhance H₂ and CH₄ Adsorption in a Uranium-Based Metal–Organic Framework Open
A new, air-stable, permanently porous uranium(IV) metal–organic framework U(bdc) 2 ( 1 , bdc 2− = 1,4-benzenedicarboxylate) was synthesized and its H 2 and CH 4 adsorption properties were investigated. Low temperature adsorption isotherms …
View article: CCDC 1943494: Experimental Crystal Structure Determination
CCDC 1943494: Experimental Crystal Structure Determination Open
View article: CCDC 1943495: Experimental Crystal Structure Determination
CCDC 1943495: Experimental Crystal Structure Determination Open
View article: CCDC 1946325: Experimental Crystal Structure Determination
CCDC 1946325: Experimental Crystal Structure Determination Open
View article: Self-adjusting binding pockets enhance H <sub>2</sub> and CH <sub>4</sub> adsorption in a uranium-based metal–organic framework
Self-adjusting binding pockets enhance H <sub>2</sub> and CH <sub>4</sub> adsorption in a uranium-based metal–organic framework Open
Optimizing binding pocket geometries in MOFs for ideal interaction with target molecules remains a tremendous synthetic challenge. In the new MOF U(bdc) 2 , self-adjusting binding pockets flex to bind differently sized guests H …
View article: CCDC 1576466: Experimental Crystal Structure Determination
CCDC 1576466: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 1534986: Experimental Crystal Structure Determination
CCDC 1534986: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 1576468: Experimental Crystal Structure Determination
CCDC 1576468: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …
View article: CCDC 1576467: Experimental Crystal Structure Determination
CCDC 1576467: Experimental Crystal Structure Determination Open
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available …