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A kinetic energy fitting metric for resolution of the identity second-order Møller-Plesset perturbation theory.The Corrole Radical.Fast Sparse Cholesky Decomposition and Inversion using Nested Dissection Matrix Reordering.How strong is it? The interpretation of force and compliance constants as bond strength descriptors.Viking Helmet Corroles: Activating Inert Oxidometal Corroles.A stable enol from a 6-substituted benzanthrone and its unexpected behaviour under acidic conditions.Preparation of imidazolin-2-iminato molybdenum and tungsten benzylidyne complexes: a new pathway to highly active alkyne metathesis catalysts.10-Heterocorroles: ring-contracted porphyrinoids with fine-tuned aromatic and metal-binding properties.Formation of paramagnetic metallacyclobutadienes by reaction of diaminoacetylenes with molybdenum alkylidyne complexes.Sulfur-bridged BODIPY DYEmers.Probing noncovalent interactions in biomolecular crystals with terahertz spectroscopy.Unraveling the Mechanism of 1,3-Diyne Cross-Metathesis Catalyzed by Silanolate-Supported Tungsten Alkylidyne Complexes.Anion binding to resorcinarene-based cavitands: the importance of C-H...anion interactions.Cationic nickel porphyrinoids with unexpected reactivity.Advances in molecular quantum chemistry contained in the Q-Chem 4 program packageFront Cover: Unraveling the Mechanism of 1,3-Diyne Cross-Metathesis Catalyzed by Silanolate-Supported Tungsten Alkylidyne Complexes (Chem. Eur. J. 36/2018)Elusive Phosphine Copper(I) Boryl Complexes: Synthesis, Structures, and ReactivityIdentification and quantification of synthetic cannabinoids in ‘spice-like’ herbal mixtures: Update of the German situation in early 2017Tuning the Catalytic Alkyne Metathesis Activity of Molybdenum and Tungsten 2,4,6-Trimethylbenzylidyne Complexes with Fluoroalkoxide Ligands OC(CF3)nMe3–n (n = 0–3)Palladium(II) Complexes with Anionic N-Heterocyclic Carbene–Borate Ligands as Catalysts for the Amination of Aryl HalidesThe Corrole RadicalNi–Fe and Pd–Fe Interactions in Nickel(II) and Palladium(II) Complexes of a Ferrocene-Bridged Bis(imidazolin-2-imine) LigandSelective B–B bond activation in an unsymmetrical diborane(4) by [(Me3P)4Rh–X] (X = Me, OtBu): a switch of mechanism?ChemInform Abstract: Synthesis of Unsymmetrical 1,3-Diynes via Alkyne Cross-Metathesis10-Heterocorroles: Ring-Contracted Porphyrinoids with Fine-Tuned Aromatic and Metal-Binding PropertiesIridium(I) Complexes with Anionic N-Heterocyclic Carbene Ligands as Catalysts for the Hydrogenation of Alkenes in Nonpolar MediaSynthesis of unsymmetrical 1,3-diynes via alkyne cross-metathesisEfficient computation of compliance matrices in redundant internal coordinates from Cartesian Hessians for nonstationary pointsExperimental and Theoretical Investigations of Catalytic Alkyne Cross-Metathesis with Imidazolin-2-iminato Tungsten Alkylidyne ComplexesAnionen bindende Resorcinaren-Cavitanden: die Bedeutung von CH⋅⋅⋅Anion-WechselwirkungenPreparation of Cyclophanes by Room-Temperature Ring-Closing Alkyne Metathesis with Imidazolin-2-iminato Tungsten Alkylidyne ComplexesEffiziente Alkinmetathese bei Raumtemperatur mit wohldefinierten Imidazolin-2-iminato-AlkylidinwolframkomplexenCharacterizing Chemical Bond Strengths Using Generalized Compliance ConstantsEfficient Room-Temperature Alkyne Metathesis with Well-Defined Imidazolin-2-iminato Tungsten Alkylidyne ComplexesHow Strong Is an Agostic Bond? Direct Assessment of Agostic Interactions Using the Generalized Compliance Matrix†
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P50
description
researcher
@en
wetenschapper
@nl
հետազոտող
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name
Kai Brandhorst
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Kai Brandhorst
@en
Kai Brandhorst
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Kai Brandhorst
@nl
Kai Brandhorst
@sl
type
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Kai Brandhorst
@ast
Kai Brandhorst
@en
Kai Brandhorst
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Kai Brandhorst
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Kai Brandhorst
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prefLabel
Kai Brandhorst
@ast
Kai Brandhorst
@en
Kai Brandhorst
@es
Kai Brandhorst
@nl
Kai Brandhorst
@sl
P106
P1153
23027178600
P31
P496
0000-0002-7028-8631